BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005629

(E)-3-phenyl-1-[(3S,5S,8S,9R,10S,12R,13R,14R,17S)-3,8,14,17-tetrahydroxy-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,15,16-dodecahydrocyclopenta[a]phenanthren-12-yl]prop-2-en-1-one

Formula: C30H42O6  |  Mol. Weight: 498.60 g/mol

IUPAC: (E)-3-phenyl-1-[(3S,5S,8S,9R,10S,12R,13R,14R,17S)-3,8,14,17-tetrahydroxy-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,5,6,7,9,11,12,15,16-dodecahydrocyclopenta[a]phenanthren-12-yl]prop-2-en-1-one

3D View Find Similar

Overview

Molecular Formula C30H42O6
Molecular Weight 498.60 g/mol
Canonical SMILES CC(C1(CCC2(C1(C(CC3C2(CCC4C3(CCC(C4)O)C)O)C(=O)C=CC5=CC=CC=C5)C)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy