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Sandorinic Acid B
FEATURES
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NAMES
  • Sandorinic acid B
SMILES
CC1(C)C(=O)CC[C@]2(C)[C@H]3C[C@@H](O)[C@@]4(C)[C@]5(O)C[C@](C)(C(=O)O)CC[C@]5(C)CC[C@]4(C)C3=CC[C@@H]12
InChI
InChI=1S/C30H46O5/c1-24(2)20-9-8-18-19(27(20,5)11-10-21(24)31)16-22(32)29(7)28(18,6)15-14-26(4)13-12-25(3,23(33)34)17-30(26,29)35/h8,19-20,22,32,35H,9-17H2,1-7H3,(H,33,34)/t19-,20-,22+,25+,26+,27+,28+,29+,30-/m0/s1
MOLECULAR FORMULA
C30H46O5
CROSS REFERENCES
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Sandorinic Acid B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 486.33
AlogP 5.53
HBond donors 3
HBond acceptors 5
Atoms 81
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Sandorinic Acid B.