-ISIS-  10201511232D

 18 19  0  0  0  0  0  0  0  0999 V2000
    6.5583   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5583   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -8.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9375   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6083   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9375   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1250   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3167   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1250   -5.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  2 11  1  0  0  0  0
 11 12  1  0  0  0  0
  8 13  2  0  0  0  0
  1 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
M  END
>  <Catalog No.>
CFN98985

>  <Name>
Suberosin

>  <CAS Number>
581-31-7

>  <Purity>
98%

>  <Formula>
C15H16O3

>  <Mol Weight>
244.3 

>  <Physical Description>
Cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Suberosin-CFN98985.html

$$$$
 
  -ISIS-  10201511232D

 20 21  0  0  0  0  0  0  0  0999 V2000
    6.5583   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5583   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -8.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9375   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6083   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -5.6542    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5583   -5.1833    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.3667   -5.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5583   -4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -4.7167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9375   -5.1833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  2 11  1  0  0  0  0
 11 12  1  0  0  0  0
  8 13  2  0  0  0  0
  1 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 16 19  1  0  0  0  0
 15 20  1  1  0  0  0
M  END
>  <Catalog No.>
CFN99738

>  <Name>
Peucedanol

>  <CAS Number>
28095-18-3

>  <Purity>
98%

>  <Formula>
C15H18O5

>  <Mol Weight>
278.30

>  <Physical Description>
White cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Peucedanol-CFN99738.html

$$$$
 
  -ISIS-  10201511232D

 20 21  0  0  0  0  0  0  0  0999 V2000
    4.2750   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2750   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -8.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3250   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542   -7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8458   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8458   -5.9458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0333   -7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -9.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -5.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708   -5.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  2 11  1  0  0  0  0
  8 12  2  0  0  0  0
  1 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 11 18  1  0  0  0  0
  6 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Catalog No.>
CFN92733

>  <Name>
Toddaculine

>  <CAS Number>
4335-12-0

>  <Purity>
98%

>  <Formula>
C16H18O4

>  <Mol Weight>
274.3

>  <Physical Description>
Cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Toddaculine-CFN92733.html

$$$$
 
  -ISIS-  10201511232D

 22 23  0  0  0  0  0  0  0  0999 V2000
    4.2750   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2750   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -8.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3250   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542   -7.3500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8458   -6.8792    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.8458   -5.9458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0333   -7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0333   -6.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -9.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542   -8.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -5.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708   -5.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  2 11  1  0  0  0  0
  8 12  2  0  0  0  0
  1 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
 11 19  1  0  0  0  0
 14 20  1  1  0  0  0
  6 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  END
>  <Catalog No.>
CFN90247

>  <Name>
Toddalolactone

>  <CAS Number>
483-90-9

>  <Purity>
98%

>  <Formula>
C16H20O6

>  <Mol Weight>
308.33

>  <Physical Description>
White powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Toddalolactone-CFN90247.html

$$$$
 
  -ISIS-  10201511232D

 21 22  0  0  0  0  0  0  0  0999 V2000
    4.2750   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2750   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -8.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3250   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542   -7.3500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8458   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8458   -5.9458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0333   -7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -9.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542   -8.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -5.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708   -5.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  2 11  1  0  0  0  0
  8 12  2  0  0  0  0
  1 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 11 18  1  0  0  0  0
 14 19  1  1  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Catalog No.>
CFN92513

>  <Name>
(-)-Toddanol

>  <CAS Number>
77715-99-2

>  <Purity>
98%

>  <Formula>
C16H18O5

>  <Mol Weight>
290.3

>  <Physical Description>
Cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Toddanol-CFN92513.html

$$$$
 
  -ISIS-  10201511232D

 21 22  0  0  0  0  0  0  0  0999 V2000
    4.2750   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2750   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -8.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3250   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542   -7.3500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8458   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8458   -5.9458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0333   -7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -9.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6542   -8.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -5.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708   -5.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  2 11  1  0  0  0  0
  8 12  2  0  0  0  0
  1 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  2  0  0  0  0
 11 18  1  0  0  0  0
 14 19  1  6  0  0  0
  6 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Catalog No.>
CFN92514

>  <Name>
Toddanone

>  <CAS Number>
77636-08-9

>  <Purity>
98%

>  <Formula>
C16H18O5

>  <Mol Weight>
290.3

>  <Physical Description>
Cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Toddanone-CFN92514.html

$$$$
 
  -ISIS-  10201511232D

 20 21  0  0  0  0  0  0  0  0999 V2000
    4.2750   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2750   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -8.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8958   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -8.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5167   -7.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7042   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3250   -8.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.8458   -6.8792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8458   -5.9458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0333   -7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4625   -9.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0833   -5.9417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708   -5.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  2 11  1  0  0  0  0
  8 12  2  0  0  0  0
  1 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 11 18  1  0  0  0  0
  6 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Catalog No.>
CFN92732

>  <Name>
5-Methoxysuberenone

>  <CAS Number>
85011-58-1

>  <Purity>
98%

>  <Formula>
C15H14O5

>  <Mol Weight>
274.3

>  <Physical Description>
Cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/5-Methoxysuberenone-CFN92732.html

$$$$
 
  -ISIS-  10201511232D

 18 20  0  0  0  0  0  0  0  0999 V2000
    6.2958   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2958   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -6.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3417   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4917   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6833   -6.3667    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.6833   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8750   -6.8333    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.8750   -7.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708   -7.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
M  END
>  <Catalog No.>
CFN92712

>  <Name>
Marmesin

>  <CAS Number>
13710-70-8

>  <Purity>
98%

>  <Formula>
C14H14O4

>  <Mol Weight>
246.3

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Marmesin-CFN92712.html

$$$$
 
  -ISIS-  10201511232D

 20 22  0  0  0  0  0  0  0  0999 V2000
    6.2958   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2958   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -6.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3417   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4917   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6833   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6833   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8750   -6.8333    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.8750   -7.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708   -7.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -4.0333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -3.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  1  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
  6 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
>  <Catalog No.>
CFN98907

>  <Name>
2-(1-Hydroxy-1-methylethyl)-4-methoxy-7H-furo[3,2-g][1]benzopyran-7-one

>  <CAS Number>
54087-32-0

>  <Purity>
98%

>  <Formula>
C15H14O5

>  <Mol Weight>
274.3 

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/2-1-Hydroxy-1-methylethyl-4-methoxy-7H-furo-3-2-g-1-benzopyran-7-one-CFN98907.html

$$$$
 
  -ISIS-  10201511232D

 19 21  0  0  0  0  0  0  0  0999 V2000
    6.2958   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2958   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -6.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3417   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4917   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6833   -6.3667    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.6833   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8750   -6.8333    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.8750   -7.7667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708   -7.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -7.7667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 13 15  1  6  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
  3 19  1  0  0  0  0
M  END
>  <Catalog No.>
CFN97825

>  <Name>
Rutaretin

>  <CAS Number>
13895-92-6

>  <Purity>
98%

>  <Formula>
C14H14O5

>  <Mol Weight>
262.26

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Rutaretin-CFN97825.html

$$$$
 
  -ISIS-  10201511232D

 19 21  0  0  0  0  0  0  0  0999 V2000
    5.0792   -5.8583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0792   -6.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8917   -7.2583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7000   -6.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7000   -5.8583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8917   -5.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5042   -7.2583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3125   -6.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3125   -5.8583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5042   -5.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1250   -7.2583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2750   -7.2583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4667   -5.8583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6583   -8.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8542   -6.7917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8542   -7.7250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8917   -8.1917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 13 15  1  1  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
  3 19  1  0  0  0  0
M  END
>  <Catalog No.>
CFN92800

>  <Name>
Qianhucoumarin G

>  <CAS Number>
68692-61-5

>  <Purity>
98%

>  <Formula>
C14H14O5

>  <Mol Weight>
262.3

>  <Physical Description>
Cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Qianhucoumarin-G-CFN92800.html

$$$$
 
  -ISIS-  10201511232D

 18 20  0  0  0  0  0  0  0  0999 V2000
    6.2958   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2958   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -6.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1083   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5292   -5.4333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7208   -4.9667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3417   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4917   -6.8333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6833   -6.3667    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    3.8750   -6.8333    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    3.0708   -6.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708   -7.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
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 10  5  1  0  0  0  0
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 14  1  1  0  0  0  0
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 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
M  END
>  <Catalog No.>
CFN98788

>  <Name>
Nodakenetin

>  <CAS Number>
495-32-9

>  <Purity>
98%

>  <Formula>
C14H14O4

>  <Mol Weight>
246.3 

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Nodakenetin-CFN98788.html

$$$$
 
  -ISIS-  10201511232D

 29 32  0  0  0  0  0  0  0  0999 V2000
    9.1708   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1708   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9667   -6.1333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7625   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7625   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9667   -4.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5583   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3542   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3542   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5583   -4.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1500   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3750   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5792   -5.6750    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.5792   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.9917   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7833   -7.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9917   -6.5917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1958   -7.0500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4000   -6.5917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6042   -7.0500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6042   -7.9708    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4000   -8.4292    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.1958   -7.9708    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4000   -9.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8083   -6.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9917   -8.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8083   -8.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0125   -7.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 19  1  0  0  0  0
 19 18  1  1  0  0  0
 23 25  1  1  0  0  0
 21 26  1  1  0  0  0
 24 27  1  6  0  0  0
 22 28  1  6  0  0  0
 26 29  1  0  0  0  0
 13 15  1  6  0  0  0
M  END
>  <Catalog No.>
CFN92711

>  <Name>
Ammijin

>  <CAS Number>
495-30-7

>  <Purity>
98%

>  <Formula>
C20H24O9

>  <Mol Weight>
408.4

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Pyridine, Methanol, Ethanol, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Ammijin-CFN92711.html

$$$$
 
  -ISIS-  10201511232D

 29 32  0  0  0  0  0  0  0  0999 V2000
    9.1708   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1708   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9667   -6.1333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7625   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7625   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9667   -4.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5583   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3542   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3542   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5583   -4.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1500   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3750   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5792   -5.6750    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.5792   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7833   -6.1333    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.9917   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7833   -7.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9917   -6.5917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1958   -7.0500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4000   -6.5917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6042   -7.0500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6042   -7.9708    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4000   -8.4292    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.1958   -7.9708    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4000   -9.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8083   -6.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9917   -8.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8083   -8.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0125   -7.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 19  1  0  0  0  0
 19 18  1  1  0  0  0
 23 25  1  1  0  0  0
 21 26  1  1  0  0  0
 24 27  1  6  0  0  0
 22 28  1  6  0  0  0
 26 29  1  0  0  0  0
 13 15  1  1  0  0  0
M  END
>  <Catalog No.>
CFN90232

>  <Name>
Nodakenin

>  <CAS Number>
495-31-8

>  <Purity>
98%

>  <Formula>
C20H24O9

>  <Mol Weight>
408.40

>  <Physical Description>
White powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Pyridine, Methanol, Ethanol, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Nodakenin-CFN90232.html

$$$$
 
  -ISIS-  10201511232D

 30 33  0  0  0  0  0  0  0  0999 V2000
    9.1708   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1708   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9667   -6.1333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7625   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7625   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9667   -4.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5583   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3542   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3542   -4.7542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5583   -4.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1500   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3750   -6.1333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5792   -5.6750    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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    6.7833   -6.1333    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.9917   -5.6750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7833   -7.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7833   -4.2958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9917   -6.5917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1958   -7.0500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4000   -6.5917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6042   -7.0500    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6042   -7.9708    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4000   -8.4292    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.1958   -7.9708    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.4000   -9.3458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8083   -6.5917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9917   -8.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8083   -8.4292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0125   -7.0500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  8 11  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  1  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 19  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 19  1  1  0  0  0
 24 26  1  1  0  0  0
 22 27  1  1  0  0  0
 25 28  1  6  0  0  0
 23 29  1  6  0  0  0
 27 30  1  0  0  0  0
 14 18  1  6  0  0  0
 13 15  1  6  0  0  0
M  END
>  <Catalog No.>
CFN97442

>  <Name>
Smyrindioloside

>  <CAS Number>
87592-77-6

>  <Purity>
98%

>  <Formula>
C20H24O10

>  <Mol Weight>
424.4 

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Pyridine, Methanol, Ethanol, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Smyrindioloside-CFN97442.html

$$$$
 
  -ISIS-  10201511232D

 22 25  0  0  0  0  0  0  0  0999 V2000
    6.5583   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5583   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -8.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -6.5875    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6500   -5.6583    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7333   -5.4625    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2667   -6.2750    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.8917   -6.9708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3292   -6.2750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3583   -4.7667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9375   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6083   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2667   -4.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4083   -5.9250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 11  1  0  0  0  0
  2 18  1  0  0  0  0
 18 19  1  0  0  0  0
  8 20  2  0  0  0  0
 13 17  1  6  0  0  0
 12 17  1  6  0  0  0
 13 21  1  1  0  0  0
 11  1  1  0  0  0  0
 11 22  1  6  0  0  0
 14 16  1  1  0  0  0
M  END
>  <Catalog No.>
CFN97519

>  <Name>
Dihydromicromelin B

>  <CAS Number>
94285-06-0

>  <Purity>
98%

>  <Formula>
C15H14O6

>  <Mol Weight>
290.3 

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Dihydromicromelin-B-CFN97519.html

$$$$
 
  -ISIS-  10201511232D

 25 28  0  0  0  0  0  0  0  0999 V2000
    6.5583   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5583   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -8.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -6.5875    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6500   -5.6583    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7333   -5.4625    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2667   -6.2750    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8917   -6.9708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3292   -6.2750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3583   -4.7667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9375   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6083   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2667   -4.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4083   -5.9250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8625   -7.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9250   -7.0833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3292   -7.8917    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 11  1  0  0  0  0
  2 18  1  0  0  0  0
 18 19  1  0  0  0  0
  8 20  2  0  0  0  0
 13 17  1  6  0  0  0
 12 17  1  6  0  0  0
 13 21  1  1  0  0  0
 11  1  1  0  0  0  0
 11 22  1  6  0  0  0
 14 16  1  6  0  0  0
 16 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
M  END
>  <Catalog No.>
CFN97520

>  <Name>
Acetyldihydromicromelin A

>  <CAS Number>
94285-22-0

>  <Purity>
98%

>  <Formula>
C17H16O7

>  <Mol Weight>
332.3 

>  <Physical Description>
Cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Acetyldihydromicromelin-A-CFN97520.html

$$$$
 
  -ISIS-  10201511232D

 22 25  0  0  0  0  0  0  0  0999 V2000
    6.5583   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5583   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -8.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1792   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3667   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8000   -7.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9875   -6.5875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -6.5875    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6500   -5.6583    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.7333   -5.4625    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2667   -6.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8917   -6.9708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3292   -6.2750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3583   -4.7667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7458   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9375   -7.9917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6083   -8.4583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2667   -4.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4083   -5.9250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 11  1  0  0  0  0
  2 18  1  0  0  0  0
 18 19  1  0  0  0  0
  8 20  2  0  0  0  0
 13 17  1  6  0  0  0
 12 17  1  6  0  0  0
 13 21  1  1  0  0  0
 11  1  1  0  0  0  0
 11 22  1  6  0  0  0
 14 16  2  0  0  0  0
M  END
>  <Catalog No.>
CFN99629

>  <Name>
Micromelin

>  <CAS Number>
15085-71-9

>  <Purity>
98%

>  <Formula>
C15H12O6

>  <Mol Weight>
288.3 

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Micromelin-CFN99629.html

$$$$
 
  -ISIS-  10201511232D

 18 20  0  0  0  0  0  0  0  0999 V2000
    6.2625   -6.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2625   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0542   -7.5833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8458   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8458   -6.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0542   -5.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4750   -5.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6833   -6.2125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6833   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4750   -7.5833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6375   -7.5833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8917   -5.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1000   -6.2125    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.1000   -7.1250    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.8917   -7.5833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1875   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8625   -8.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3083   -5.7583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  2  1  0  0  0  0
  4 11  2  0  0  0  0
  8 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15  9  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 13 18  1  0  0  0  0
M  END
>  <Catalog No.>
CFN92775

>  <Name>
3',4'-dihydro-3'-hydroxy-Xanthyletin

>  <CAS Number>
5993-18-0

>  <Purity>
98%

>  <Formula>
C14H14O4

>  <Mol Weight>
246.3

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/3-4-dihydro-3-hydroxy-Xanthyletin-CFN92775.html

$$$$
 
  -ISIS-  10201511232D

 18 20  0  0  0  0  0  0  0  0999 V2000
    6.5792   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5792   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3708   -6.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1625   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1625   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3708   -4.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917   -4.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917   -6.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9542   -6.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2083   -4.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4167   -5.2917    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.4167   -6.2042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.2083   -6.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5042   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1792   -7.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6250   -4.8375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  2  1  0  0  0  0
  4 11  2  0  0  0  0
  8 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15  9  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 13 18  1  1  0  0  0
M  END
>  <Catalog No.>
CFN90496

>  <Name>
Decursinol

>  <CAS Number>
23458-02-8

>  <Purity>
98%

>  <Formula>
C14H14O4

>  <Mol Weight>
246.26

>  <Physical Description>
Powder

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Decursinol-CFN90496.html

$$$$
 
  -ISIS-  10201511232D

 24 26  0  0  0  0  0  0  0  0999 V2000
    6.5792   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5792   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3708   -6.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1625   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1625   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3708   -4.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917   -4.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7917   -6.6625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9542   -6.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2083   -4.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4167   -5.2917    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.4167   -6.2042    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.2083   -6.6625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5042   -6.2042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1792   -7.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6250   -4.8375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6250   -3.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4167   -3.4667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8375   -3.4667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4167   -2.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2083   -2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6250   -2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  2  1  0  0  0  0
  4 11  2  0  0  0  0
  8 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15  9  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 13 18  1  1  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
M  END
>  <Catalog No.>
CFN98509

>  <Name>
Decursin

>  <CAS Number>
5928-25-6

>  <Purity>
98%

>  <Formula>
C19H20O5

>  <Mol Weight>
328.36

>  <Physical Description>
White cryst.

>  <Type of Compound>
Coumarins

>  <Solvent>
Chloroform, Dichloromethane, Ethyl Acetate, DMSO, Acetone, etc.

>  <WebLink>
http://www.chemfaces.com/natural/Decursin-CFN98509.html

$$$$