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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034760

(3R,4S,6R)-6-[(1R)-1-hydroxy-1-[(7S,8S,9S,10R,13S,14S,17S)-7-hydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethyl]-3,4-dimethyloxan-2-one

Formula: C28H40O5  |  Mol. Weight: 456.60 g/mol

IUPAC: (3R,4S,6R)-6-[(1R)-1-hydroxy-1-[(7S,8S,9S,10R,13S,14S,17S)-7-hydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethyl]-3,4-dimethyloxan-2-one

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Overview

Molecular Formula C28H40O5
Molecular Weight 456.60 g/mol
Canonical SMILES CC1CC(OC(=O)C1C)C(C)(C2CCC3C2(CCC4C3C(C=C5C4(C(=O)C=CC5)C)O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy