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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP023301

(25r)-26-O-beta-d-glucopyranosyl-5alpha-furost-20(22)-en-12-one-3beta,26-diol

Formula: C33H52O9  |  Mol. Weight: 592.80 g/mol

IUPAC: (1R,2S,4S,8R,9S,12S,13S,16S,18S)-16-hydroxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-6-en-10-one

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Overview

Molecular Formula C33H52O9
Molecular Weight 592.80 g/mol
Canonical SMILES CC1=C(OC2C1C3(C(C2)C4CCC5CC(CCC5(C4CC3=O)C)O)C)CCC(C)COC6C(C(C(C(O6)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy