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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034099

Thebaine N-oxide

Formula: C19H21NO4  |  Mol. Weight: 327.40 g/mol

IUPAC: (4R,7aR,12bS)-7,9-dimethoxy-3-methyl-3-oxido-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium

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Overview

Molecular Formula C19H21NO4
Molecular Weight 327.40 g/mol
Canonical SMILES C[N+]1(CCC23C4C(=CC=C2C1CC5=C3C(=C(C=C5)OC)O4)OC)[O-]

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy