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13E-Globostellatic Acid B Methyl Ester
FEATURES
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NAMES
  • 13E-Globostellatic Acid B Methyl Ester
SMILES
COC(=O)[C@@]1(C)[C@H](OC(C)=O)CC[C@]2(C)[C@@H]3CC(=O)/C(=C(C)/C=C/C=C(\C)C(/C=C/C(C)(C)O)OC)[C@@]3(C)CC[C@H]21
InChI
InChI=1S/C34H50O7/c1-21(25(39-9)14-17-31(4,5)38)12-11-13-22(2)29-24(36)20-27-32(6)19-16-28(41-23(3)35)34(8,30(37)40-10)26(32)15-18-33(27,29)7/h11-14,17,25-28,38H,15-16,18-20H2,1-10H3/b13-11+,17-14+,21-12+,29-22-/t25?,26-,27+,28-,32+,33+,34-/m1/s1
MOLECULAR FORMULA
C34H50O7
CROSS REFERENCES
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13E-Globostellatic Acid B Methyl Ester

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 570.36
AlogP 6.06
HBond donors 1
HBond acceptors 7
Atoms 91
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 13E-Globostellatic Acid B Methyl Ester.