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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP025632

(1S,4aR,6aR,6aS,6bR,8aR,10S,12aR,14aR,14bR)-10-hydroxy-4a-methoxycarbonyl-1,2,6b,9,9,12a-hexamethyl-4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydro-1H-picene-6a-carboxylic acid

Formula: C31H48O5  |  Mol. Weight: 500.70 g/mol

IUPAC: (1S,4aR,6aR,6aS,6bR,8aR,10S,12aR,14aR,14bR)-10-hydroxy-4a-methoxycarbonyl-1,2,6b,9,9,12a-hexamethyl-4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydro-1H-picene-6a-carboxylic acid

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Overview

Molecular Formula C31H48O5
Molecular Weight 500.70 g/mol
Canonical SMILES CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CC=C1C)C(=O)OC)C(=O)O)C)(C)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy