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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007151

(3aS,4S,5aR,5bR,7aR,9S,11aR,11bR,13R,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-3-methylidene-2,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-tetradecahydro-1H-cyclopenta[a]chrysene-4,9,13-triol

Formula: C28H46O3  |  Mol. Weight: 430.70 g/mol

IUPAC: (3aS,4S,5aR,5bR,7aR,9S,11aR,11bR,13R,13aR,13bS)-5a,5b,8,8,11a,13b-hexamethyl-3-methylidene-2,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-tetradecahydro-1H-cyclopenta[a]chrysene-4,9,13-triol

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Overview

Molecular Formula C28H46O3
Molecular Weight 430.70 g/mol
Canonical SMILES CC1(C2CCC3(C(C2(CCC1O)C)CC(C4C3(CC(C5C4(CCC5=C)C)O)C)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy