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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002716

[(2E)-2-[(6R,7S)-6-hydroxy-7-[(E,4R)-8-hydroxy-4,8-dimethyl-5-oxonon-6-enyl]-7-methyloxepan-3-ylidene]ethyl] acetate

Formula: C22H36O6  |  Mol. Weight: 396.50 g/mol

IUPAC: [(2E)-2-[(6R,7S)-6-hydroxy-7-[(E,4R)-8-hydroxy-4,8-dimethyl-5-oxonon-6-enyl]-7-methyloxepan-3-ylidene]ethyl] acetate

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Overview

Molecular Formula C22H36O6
Molecular Weight 396.50 g/mol
Canonical SMILES CC(CCCC1(C(CCC(=CCOC(=O)C)CO1)O)C)C(=O)C=CC(C)(C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy