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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP028140

(5S,9R,10S,13R,14R,17R)-17-[(2R,5S,6S)-7-hydroxy-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,4,5,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Formula: C28H44O2  |  Mol. Weight: 412.60 g/mol

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

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Overview

Molecular Formula C28H44O2
Molecular Weight 412.60 g/mol
Canonical SMILES CC(CO)C(C)C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(=O)C4)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy