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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP021322

(2S)-3-[(1R,2S,4aS,4bR,6aR,10aR,10bS,12aS)-2-ethyl-2,4b,6a,9,9,10b,12a-heptamethyl-1,3,4,4a,5,6,7,8,10,10a,11,12-dodecahydrochrysen-1-yl]-2-hydroxypropanoic acid

Formula: C30H52O3  |  Mol. Weight: 460.70 g/mol

IUPAC: (2S)-3-[(1R,2S,4aS,4bR,6aR,10aR,10bS,12aS)-2-ethyl-2,4b,6a,9,9,10b,12a-heptamethyl-1,3,4,4a,5,6,7,8,10,10a,11,12-dodecahydrochrysen-1-yl]-2-hydroxypropanoic acid

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Overview

Molecular Formula C30H52O3
Molecular Weight 460.70 g/mol
Canonical SMILES CCC1(CCC2C(C1CC(C(=O)O)O)(CCC3(C2(CCC4(C3CC(CC4)(C)C)C)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy