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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016328

(1R,2R,4aR,6aR,6aR,6bR,8aR,10S,12aR,14aR,14bR)-2,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydropicene-4a-carboxylic acid

Formula: C30H48O4  |  Mol. Weight: 472.70 g/mol

IUPAC: (1R,2R,4aR,6aR,6aR,6bR,8aR,10S,12aR,14aR,14bR)-2,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydropicene-4a-carboxylic acid

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Overview

Molecular Formula C30H48O4
Molecular Weight 472.70 g/mol
Canonical SMILES CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(C=CC1(C)O)C(=O)O)C)C)(C)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy