Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(C=C1)C(CC(=O)NCC1=CC=CC=C1)C1=CNC2=C1C(OC)=CC=C2

InChIKey

InChIKey=NCRPHUOJDGUYES-UHFFFAOYSA-N

Formula

C27H26N2O4

Mass

442.515

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Tryptamines and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Tryptamines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Triptan - P-cymene - Aromatic monoterpenoid - Benzoate ester - Bicyclic monoterpenoid - Monoterpenoid - 3-alkylindole - Benzoic acid or derivatives - Indole - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Benzenoid - Substituted pyrrole - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Methyl ester - Pyrrole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ether - Azacycle - Carboxylic acid derivative - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as tryptamines and derivatives. These are compounds containing the tryptamine backbone, which is structurally characterized by an indole ring substituted at the 3-position by an ethanamine.

External Descriptors

Not available

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