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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP030603

6-alpha-Acetoxygedunin

Formula: C30H36O9  |  Mol. Weight: 540.60 g/mol

IUPAC: [(1S,2R,4S,7S,8S,11R,12R,17R,18R,19S)-19-acetyloxy-7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadec-13-en-18-yl] acetate

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Overview

Molecular Formula C30H36O9
Molecular Weight 540.60 g/mol
Canonical SMILES CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(OC(=O)C5C4(C3(C1OC(=O)C)C)O5)C6=COC=C6)C)C)(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy