-ISIS-  05031710462D

 35 37  0  0  0  0  0  0  0  0999 V2000
    7.5125   -7.6750    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.2667   -8.3375    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.0667   -7.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2667   -9.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0667   -6.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2625   -6.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4500   -6.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4500   -7.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2625   -8.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0792   -9.7375    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.0792  -10.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8833   -9.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2625   -9.0250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6375   -6.2208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8792   -6.2208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3042   -8.1667    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.1375   -7.7333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1375   -6.7958    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.3042   -6.2958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5125   -6.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3042   -9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1375   -9.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9625   -9.1583    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.9625   -8.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7667   -9.6292    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.7667  -10.5625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5750   -9.1583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5750  -10.0958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7083   -7.2042    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5000   -8.6333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9458   -6.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2625   -5.2917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0708   -5.7583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6458   -8.0875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4542   -8.5542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  3  1  0  0  0  0
  4 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
  9 13  1  0  0  0  0
  7 14  1  0  0  0  0
  5 15  1  0  0  0  0
  2  1  1  0  0  0  0
  2  3  1  0  0  0  0
  1 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20  1  1  0  0  0  0
 16 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 17  2  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 25 28  1  0  0  0  0
  2  4  1  1  0  0  0
  1 29  1  1  0  0  0
 16 30  1  6  0  0  0
 23 25  1  6  0  0  0
  6 32  1  0  0  0  0
  8 34  1  0  0  0  0
 18 31  1  6  0  0  0
  3  5  2  0  0  0  0
 32 33  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
 34 35  2  0  0  0  0
G   32  6
C^HO
G   34  8
C^HO
M  STY  2   1 SUP   2 SUP
M  SLB  2   1   1   2   2
M  SAL   1  2  32  33
M  SBL   1  1  30
M  SMT   1 C^HO
M  SBV   1  30    0.0000   -0.9300
M  SAL   2  2  34  35
M  SBL   2  1  31
M  SMT   2 C^HO
M  SBV   2  31    0.8100    0.4600
M  END
>  <Catalog No.>
CFN99470

>  <Name>
Macrocarpal E

>  <CAS Number>
142628-54-4

>  <Purity>
98%

>  <Formula>
C28H40O6

>  <Mol Weight>
472.6 

>  <Physical Description>
Yellow powder

>  <Type of Compound>
Sesquiterpenoids

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

>  <WebLink>
http://www.chemfaces.com/natural/Macrocarpal-E-CFN99470.html

$$$$