Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)CN1C=NC(C[C@H](NC(=O)C2=CC=C(C=C2)N(C)CC2=CN=C3N=C(N)N=C(N)C3=N2)C(=O)OC)=C1

InChIKey

InChIKey=YWHLBVPIWCLILO-IBGZPJMESA-N

Formula

C26H30N10O5

Mass

562.591

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Histidine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Histidine or derivatives - Alpha-amino acid ester - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - Pteridine - Benzoic acid or derivatives - Benzamide - Benzoyl - Imidazolyl carboxylic acid derivative - Aniline or substituted anilines - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aralkylamine - Fatty acid ester - Aminopyrimidine - Dicarboxylic acid or derivatives - Imidolactam - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Fatty acyl - Pyrazine - Pyrimidine - Methyl ester - Azole - Heteroaromatic compound - Imidazole - Carboxylic acid ester - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as histidine and derivatives. These are compounds containing cysteine or a derivative thereof resulting from reaction of cysteine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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