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11Alpha-Hydroxygedunin
FEATURES
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NAMES
  • 11Alpha-Hydroxygedunin
SMILES
CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]2[C@H](O)C[C@@]3(C)[C@H](c4ccoc4)OC(=O)[C@H]4O[C@]43[C@]12C
InChI
InChI=1S/C28H34O8/c1-14(29)34-19-11-17-24(2,3)18(31)7-9-25(17,4)20-16(30)12-26(5)21(15-8-10-33-13-15)35-23(32)22-28(26,36-22)27(19,20)6/h7-10,13,16-17,19-22,30H,11-12H2,1-6H3/t16-,17+,19-,20-,21+,22-,25+,26+,27-,28-/m1/s1
MOLECULAR FORMULA
C28H34O8
CROSS REFERENCES
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11Alpha-Hydroxygedunin

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 498.23
AlogP 3.53
HBond donors 1
HBond acceptors 8
Atoms 70
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 11Alpha-Hydroxygedunin.