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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031328

[(1R,2R,4R,6R,8S,9Z,11R)-8-acetyloxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] (E)-4-hydroxy-2-(hydroxymethyl)but-2-enoate

Formula: C22H28O9  |  Mol. Weight: 436.50 g/mol

IUPAC: [(1R,2R,4R,6R,8S,9Z,11R)-8-acetyloxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl] (E)-4-hydroxy-2-(hydroxymethyl)but-2-enoate

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Overview

Molecular Formula C22H28O9
Molecular Weight 436.50 g/mol
Canonical SMILES CC1=CC2C(C(CC3(C(O3)CC1OC(=O)C)C)OC(=O)C(=CCO)CO)C(=C)C(=O)O2

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy