-ISIS-  05031710462D

 46 49  0  0  0  0  0  0  0  0999 V2000
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    2.9333   -5.7583    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.5042   -7.5750    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    5.2958   -4.3917    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.7167   -5.3042    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2958   -5.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7167   -8.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5042   -2.1208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5042   -3.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.8667   -1.6667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5042   -8.4833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2917   -9.8458    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  4  5  1  0  0  0  0
  5  6  1  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  1  0  0  0  0
 10  5  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  5 13  1  1  0  0  0
 10 14  1  6  0  0  0
  9 15  1  6  0  0  0
  4 16  1  6  0  0  0
 12 17  1  0  0  0  0
 19 20  1  0  0  0  0
 20 17  1  0  0  0  0
 18 21  1  0  0  0  0
 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 17 18  2  0  0  0  0
  7 23  1  6  0  0  0
 16 43  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 12 27  1  0  0  0  0
  6 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 29 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
 32 34  1  0  0  0  0
 27 35  1  0  0  0  0
 35 36  1  0  0  0  0
 35 37  2  0  0  0  0
 36 38  2  0  0  0  0
 36 39  1  0  0  0  0
 38 40  1  0  0  0  0
  3 41  1  6  0  0  0
 41 42  1  0  0  0  0
  3 42  1  1  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
 43 45  1  0  0  0  0
 44 45  2  0  0  0  0
 45 46  1  0  0  0  0
G   43 16
OAc
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  4  43  44  45  46
M  SBL   1  1  23
M  SMT   1 OAc
M  SBV   1  23   -0.2400    0.8800
M  END
>  <Catalog No.>
CFN92753

>  <Name>
Ajugamarin H1

>  <CAS Number>
122616-88-0

>  <Purity>
98%

>  <Formula>
C34H48O11

>  <Mol Weight>
632.8

>  <Physical Description>
Powder

>  <Type of Compound>
Diterpenoids

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

>  <WebLink>
http://www.chemfaces.com/natural/Ajugamarin-H1-CFN92753.html

$$$$