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Firmianone A
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NAMES
  • Firmianone A
SMILES
CC1=C[C@@H]2c3c(c(O)c4ccccc4c3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@]3(O)c4ccccc4C(=O)[C@]2(/C=C/C(C)(C)O)[C@@]3(O)C1
InChI
InChI=1S/C36H38O11/c1-17-14-22-24-25(26(38)18-8-4-5-9-19(18)30(24)47-32-29(41)28(40)27(39)23(16-37)46-32)36(45)21-11-7-6-10-20(21)31(42)34(22,35(36,44)15-17)13-12-33(2,3)43/h4-14,22-23,27-29,32,37-41,43-45H,15-16H2,1-3H3/b13-12+/t22-,23-,27-,28+,29-,32+,34-,35+,36+/m1/s1
MOLECULAR FORMULA
C36H38O11
CROSS REFERENCES
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Firmianone A

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 646.24
AlogP 1.65
HBond donors 8
HBond acceptors 11
Atoms 85
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 Firmianone A.