BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP000958

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

Formula: C28H40O8  |  Mol. Weight: 504.60 g/mol

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

3D View Find Similar

Overview

Molecular Formula C28H40O8
Molecular Weight 504.60 g/mol
Canonical SMILES CC1=C(C(=O)OC(C1)C(C)(C2(CCC3(C2(CCC4C3(CC=C5C4(C(=O)CCC5)C)O)C)O)O)O)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy