Structure Information
Structure

Compound Identification

SMILES

NC(=O)[C@@H]1CC2=C(NC3=CC=CC=C23)[C@H](N1)C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=UYWCQMMJKVBPTD-WMLDXEAASA-N

Formula

C19H17N3O3

Mass

335.363

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Harmala alkaloids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Harmala alkaloids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Harman - Beta-carboline - Pyridoindole - Alpha-amino acid amide - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Benzodioxole - Indole or derivatives - Aralkylamine - Benzenoid - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Azacycle - Secondary aliphatic amine - Oxacycle - Carboxylic acid derivative - Acetal - Organoheterocyclic compound - Secondary amine - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as harmala alkaloids. These are compounds with a structure based on harmaline, harmine, harmalol, harman or a derivative of those parents. These parents are beta-carbolines, consisting of a pyrimidine fused to the pyrrole moiety of an indole to form a pyrido[3,4-b]indole.

External Descriptors

Not available

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