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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP033749

[(3aR,4S,9aR,9bR)-9-(hydroxymethyl)-6-methyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-4-yl] 2-(4-hydroxyphenyl)acetate

Formula: C23H22O7  |  Mol. Weight: 410.40 g/mol

IUPAC: [(3aR,4S,9aR,9bR)-9-(hydroxymethyl)-6-methyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-4-yl] 2-(4-hydroxyphenyl)acetate

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Overview

Molecular Formula C23H22O7
Molecular Weight 410.40 g/mol
Canonical SMILES CC1=C2C(C3C(C(C1)OC(=O)CC4=CC=C(C=C4)O)C(=C)C(=O)O3)C(=CC2=O)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy