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Porrigenin B
FEATURES
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NAMES
  • Porrigenin B
SMILES
C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4C[C@@H](O)[C@H]5C[C@@H](O)C(=O)C[C@]5(C)[C@H]4CC[C@@]32C)O[C@]12CC[C@@H](C)CO2
InChI
InChI=1S/C27H42O5/c1-14-5-8-27(31-13-14)15(2)24-23(32-27)11-18-16-9-20(28)19-10-21(29)22(30)12-26(19,4)17(16)6-7-25(18,24)3/h14-21,23-24,28-29H,5-13H2,1-4H3/t14-,15+,16-,17+,18+,19-,20-,21-,23+,24+,25+,26-,27-/m1/s1
MOLECULAR FORMULA
C27H42O5
CROSS REFERENCES
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Porrigenin B

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 446.30
AlogP 3.94
HBond donors 2
HBond acceptors 5
Atoms 74
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 Porrigenin B.