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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008070

(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-(1-methoxy-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-10-ium-11-yl)phenoxy]oxane-3,4,5-triol

Formula: C25H31N2O7+  |  Mol. Weight: 471.50 g/mol

IUPAC: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-(1-methoxy-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-10-ium-11-yl)phenoxy]oxane-3,4,5-triol

Overview

Molecular Formula C25H31N2O7+
Molecular Weight 471.50 g/mol
Canonical SMILES CC1=CC2=C(C(=C1)OC)C(=[N+]3N2CCCC3)C4=CC=C(C=C4)OC5C(C(C(C(O5)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy