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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP021321

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

Formula: C30H50O2  |  Mol. Weight: 442.70 g/mol

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

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Overview

Molecular Formula C30H50O2
Molecular Weight 442.70 g/mol
Canonical SMILES CC1(CCC2(CCC3(C4CCC(C(C4(CCC3(C2C1)C)C)CCC(=O)O)(C)C=C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy