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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035672

[(3S,3aR,4R,5R,9aR,9bS)-4-acetyloxy-9a-hydroxy-3,6,9-trimethyl-2-oxo-3,3a,4,5,7,9b-hexahydroazuleno[4,5-b]furan-5-yl] (Z)-2-methylbut-2-enoate

Formula: C22H28O7  |  Mol. Weight: 404.50 g/mol

IUPAC: [(3S,3aR,4R,5R,9aR,9bS)-4-acetyloxy-9a-hydroxy-3,6,9-trimethyl-2-oxo-3,3a,4,5,7,9b-hexahydroazuleno[4,5-b]furan-5-yl] (Z)-2-methylbut-2-enoate

Overview

Molecular Formula C22H28O7
Molecular Weight 404.50 g/mol
Canonical SMILES CC=C(C)C(=O)OC1C(C2C(C(=O)OC2C3(C(=CCC3=C1C)C)O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy