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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002423

(3R,4R,4aR,6aS,6bR,8aR,12aR,14bS)-3-acetyloxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a-dodecahydropicene-4-carboxylic acid

Formula: C32H48O4  |  Mol. Weight: 496.70 g/mol

IUPAC: (3R,4R,4aR,6aS,6bR,8aR,12aR,14bS)-3-acetyloxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a-dodecahydropicene-4-carboxylic acid

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Overview

Molecular Formula C32H48O4
Molecular Weight 496.70 g/mol
Canonical SMILES CC(=O)OC1CCC2(C(C1(C)C(=O)O)CCC3(C2=CC=C4C3(CCC5(C4CC(CC5)(C)C)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy