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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038721

(2S,4aS,6aR,7R,10aS,12S,12aS)-7-(4-hydroxy-6-methylheptan-2-yl)-4a,6a-dimethyl-1,2,3,4,6,7,8,9,10,10a,10b,11,12,12a-tetradecahydrochrysene-2,12-diol

Formula: C28H48O3  |  Mol. Weight: 432.70 g/mol

IUPAC: (2S,4aS,6aR,7R,10aS,12S,12aS)-7-(4-hydroxy-6-methylheptan-2-yl)-4a,6a-dimethyl-1,2,3,4,6,7,8,9,10,10a,10b,11,12,12a-tetradecahydrochrysene-2,12-diol

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Overview

Molecular Formula C28H48O3
Molecular Weight 432.70 g/mol
Canonical SMILES CC(C)CC(CC(C)C1CCCC2C1(CC=C3C2CC(C4C3(CCC(C4)O)C)O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy