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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007365

(2R)-2-[(1S)-1-[(5R,6R,8R,9S,10R,13S,14R,17S)-6-ethoxy-5,14,17-trihydroxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

Formula: C30H44O8  |  Mol. Weight: 532.70 g/mol

IUPAC: (2R)-2-[(1S)-1-[(5R,6R,8R,9S,10R,13S,14R,17S)-6-ethoxy-5,14,17-trihydroxy-10,13-dimethyl-1-oxo-6,7,8,9,11,12,15,16-octahydro-4H-cyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

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Overview

Molecular Formula C30H44O8
Molecular Weight 532.70 g/mol
Canonical SMILES CCOC1CC2C(CCC3(C2(CCC3(C(C)(C4CC(=C(C(=O)O4)C)C)O)O)O)C)C5(C1(CC=CC5=O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy