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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026065

[(1R,2R,3R,4S,5S,7R,9S,10R,14R)-2-acetyloxy-7-hydroxy-1,5,9,12,12-pentamethyl-8,13-dioxo-4-tetracyclo[7.6.0.03,7.010,14]pentadecanyl] benzoate

Formula: C29H36O7  |  Mol. Weight: 496.60 g/mol

IUPAC: [(1R,2R,3R,4S,5S,7R,9S,10R,14R)-2-acetyloxy-7-hydroxy-1,5,9,12,12-pentamethyl-8,13-dioxo-4-tetracyclo[7.6.0.03,7.010,14]pentadecanyl] benzoate

Overview

Molecular Formula C29H36O7
Molecular Weight 496.60 g/mol
Canonical SMILES CC1CC2(C(C1OC(=O)C3=CC=CC=C3)C(C4(CC5C(C4(C2=O)C)CC(C5=O)(C)C)C)OC(=O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy