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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005796

(2R,4aR,5R,6aR,6aR,6bR,8aR,10S,12aR,14bS)-5-hydroxy-10-methoxy-2,6b,9,9,12a-pentamethyl-1-methylidene-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a,6a-dicarboxylic acid

Formula: C31H46O6  |  Mol. Weight: 514.70 g/mol

IUPAC: (2R,4aR,5R,6aR,6aR,6bR,8aR,10S,12aR,14bS)-5-hydroxy-10-methoxy-2,6b,9,9,12a-pentamethyl-1-methylidene-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a,6a-dicarboxylic acid

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Overview

Molecular Formula C31H46O6
Molecular Weight 514.70 g/mol
Canonical SMILES CC1CCC2(C(CC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC)C)C)C2C1=C)C(=O)O)O)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy