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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034757

[(1R,3E,5R,7S,10E,12S,13S,14S)-1-acetyloxy-10-(acetyloxymethyl)-3,6,6,14-tetramethyl-2-oxo-13-tricyclo[10.3.0.05,7]pentadeca-3,10-dienyl] (2R)-2-hydroxy-2-phenylacetate

Formula: C32H40O8  |  Mol. Weight: 552.70 g/mol

IUPAC: [(1R,3E,5R,7S,10E,12S,13S,14S)-1-acetyloxy-10-(acetyloxymethyl)-3,6,6,14-tetramethyl-2-oxo-13-tricyclo[10.3.0.05,7]pentadeca-3,10-dienyl] (2R)-2-hydroxy-2-phenylacetate

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Overview

Molecular Formula C32H40O8
Molecular Weight 552.70 g/mol
Canonical SMILES CC1CC2(C(C1OC(=O)C(C3=CC=CC=C3)O)C=C(CCC4C(C4(C)C)C=C(C2=O)C)COC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy