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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038491

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

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

IUPAC: (2R)-2-[(1R)-2-hydroxy-1-[(8S,9S,10R,12S,13S,14S,17R)-12-hydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]ethyl]-5-(hydroxymethyl)-4-methyl-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(CO)C2CCC3C2(C(CC4C3CC=C5C4(C(=O)C=CC5)C)O)C)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy