Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CO[C@@H](C)[C@H]2C[N+]3=C(C[C@H]12)C1=C(C=C3)C2=CC=CC=C2[NH2+]1

InChIKey

InChIKey=WYTGDNHDOZPMIW-VBNZEHGJSA-P

Formula

C21H22N2O3

Mass

350.417

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Pyridoindoles

Intermediate Tree Nodes

Not available

Direct Parent

Beta carbolines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Beta-carboline - Primary aromatic amine - Pyridine - Pyridinium - Benzenoid - Heteroaromatic compound - Methyl ester - Enoate ester - Vinylogous ester - Alpha,beta-unsaturated carboxylic ester - Amino acid or derivatives - Carboxylic acid ester - Oxacycle - Secondary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as beta carbolines. These are compounds containing a 9H-pyrido[3,4-b]indole moiety.

External Descriptors

Not available

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