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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003678

(22s,25r)-3beta,11alpha,16beta,22-Tetrahydroxycholest-5-en-26-yl beta-d-glucopyranoside

Formula: C33H56O10  |  Mol. Weight: 612.80 g/mol

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

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Overview

Molecular Formula C33H56O10
Molecular Weight 612.80 g/mol
Canonical SMILES CC(CCC(C(C)C1C(CC2C1(CC(C3C2CC=C4C3(CCC(C4)O)C)O)C)O)O)COC5C(C(C(C(O5)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy