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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031494

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

Formula: C28H40O7  |  Mol. Weight: 488.60 g/mol

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

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Overview

Molecular Formula C28H40O7
Molecular Weight 488.60 g/mol
Canonical SMILES CC1C(C(C(OC1=O)C(C)(C2CCC3(C2(CCC4C3CC=C5C4(C(=O)C=CC5)C)C)O)O)O)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy