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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP032616

(2S,3S,9S,10S)-9-hydroxy-4-methyl-4-oxido-11,16,18-trioxa-4-azoniapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),7,13,15(19)-tetraen-12-one

Formula: C17H17NO6  |  Mol. Weight: 331.32 g/mol

IUPAC: (2S,3S,9S,10S)-9-hydroxy-4-methyl-4-oxido-11,16,18-trioxa-4-azoniapentacyclo[11.7.0.02,10.03,7.015,19]icosa-1(20),7,13,15(19)-tetraen-12-one

Overview

Molecular Formula C17H17NO6
Molecular Weight 331.32 g/mol
Canonical SMILES C[N+]1(CCC2=CC(C3C(C21)C4=CC5=C(C=C4C(=O)O3)OCO5)O)[O-]

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy