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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP011440

[(1R,2R,3R,4S,6R,7S,9R,10S,11S,13S)-2,6-diacetyloxy-3,7-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

Formula: C26H36O9  |  Mol. Weight: 492.60 g/mol

IUPAC: [(1R,2R,3R,4S,6R,7S,9R,10S,11S,13S)-2,6-diacetyloxy-3,7-dihydroxy-5,5,9-trimethyl-14-methylidene-15-oxo-11-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate

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Overview

Molecular Formula C26H36O9
Molecular Weight 492.60 g/mol
Canonical SMILES CC(=O)OC1CC2CC3(C1C4(CC(C(C(C4C(C3OC(=O)C)O)(C)C)OC(=O)C)O)C)C(=O)C2=C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy