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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005775

2-[(1R)-1-[(5S,9S,10R,13R,14S,17S)-5,14-dihydroxy-10,13-dimethyl-1-oxo-4,6,9,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

Formula: C28H38O6  |  Mol. Weight: 470.60 g/mol

IUPAC: 2-[(1R)-1-[(5S,9S,10R,13R,14S,17S)-5,14-dihydroxy-10,13-dimethyl-1-oxo-4,6,9,11,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

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Overview

Molecular Formula C28H38O6
Molecular Weight 470.60 g/mol
Canonical SMILES CC1=C(C(=O)OC(C1)C(C)(C2CCC3(C2(CCC4C3=CCC5(C4(C(=O)C=CC5)C)O)C)O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy