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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP019110

methyl (1S,9S,13E,15S)-13-ethylidene-18-(hydroxymethyl)-15-methyl-8-aza-15-azoniapentacyclo[10.5.1.01,9.02,7.09,15]octadeca-2,4,6-triene-18-carboxylate

Formula: C22H29N2O3+  |  Mol. Weight: 369.50 g/mol

IUPAC: methyl (1S,9S,13E,15S)-13-ethylidene-18-(hydroxymethyl)-15-methyl-8-aza-15-azoniapentacyclo[10.5.1.01,9.02,7.09,15]octadeca-2,4,6-triene-18-carboxylate

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Overview

Molecular Formula C22H29N2O3+
Molecular Weight 369.50 g/mol
Canonical SMILES CC=C1C[N+]2(CCC34C2(CCC1C3(CO)C(=O)OC)NC5=CC=CC=C45)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy