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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP088548

Heroin

Formula: C21H23NO5  |  Mol. Weight: 369.40 g/mol

IUPAC: [(4R,4aR,7S,7aR,12bS)-9-acetyloxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] acetate

Overview

Molecular Formula C21H23NO5
Molecular Weight 369.40 g/mol
Canonical SMILES CC(=O)OC1C=CC2C3CC4=C5C2(C1OC5=C(C=C4)OC(=O)C)CCN3C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Therapeutics & Targets

Disease Associations