BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP023180

(23r,24s)-6beta,23,24-Trihydroxy-5alpha-cholestane-3beta,16beta-diyl bis-beta-d-glucopyranoside

Formula: C39H68O15  |  Mol. Weight: 776.90 g/mol

IUPAC: (2R,3R,4S,5S,6R)-2-[[(3S,5S,6R,8R,9S,10R,13S,14S,16S,17R)-17-[(2R,4R,5S)-4,5-dihydroxy-6-methylheptan-2-yl]-6-hydroxy-10,13-dimethyl-16-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Overview

Molecular Formula C39H68O15
Molecular Weight 776.90 g/mol
Canonical SMILES CC(C)C(C(CC(C)C1C(CC2C1(CCC3C2CC(C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)O)C)OC6C(C(C(C(O6)CO)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy