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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007156

(3R,4R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-4-acetyloxy-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-[(2E,4E)-6-methylocta-2,4-dienoyl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Formula: C41H62O7  |  Mol. Weight: 666.90 g/mol

IUPAC: (3R,4R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-4-acetyloxy-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-3-[(2E,4E)-6-methylocta-2,4-dienoyl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Overview

Molecular Formula C41H62O7
Molecular Weight 666.90 g/mol
Canonical SMILES CCC(C)C=CC=CC(=O)OC1C(C2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2CC1(C)C)C)C(=O)O)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy