Structure Information
Structure

Compound Identification

SMILES

CCCC(NC(=O)C1=CC=C(NCC2=CN=C3N(C(N)NC(=O)C3=N2)C(O)=O)C=C1)C(O)=O

InChIKey

InChIKey=COWAFRPFOZSILS-UHFFFAOYSA-N

Formula

C20H23N7O6

Mass

457.447

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pteridines and derivatives

Subclass

Pterins and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pterin carboxylates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pterin-1-carboxylate - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Hippuric acid or derivatives - Alpha-amino acid or derivatives - Aminobenzamide - Aminobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - 2-heteroaryl carboxamide - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Aralkylamine - Secondary aliphatic/aromatic amine - Pyrazine - Monocyclic benzene moiety - Imidolactam - Benzenoid - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Amino acid - Tertiary amine - Carbamic acid - Carbamic acid derivative - Carboxamide group - Secondary carboxylic acid amide - Lactam - Orthocarboxylic acid derivative - Ortho amide - Carboxylic acid derivative - Carboxylic acid - Secondary amine - Monocarboxylic acid or derivatives - Azacycle - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pterin carboxylates. These are heterocyclic aromatic compounds containing a pterin moiety, in which one ring is substituted by one or more carboxylic acid groups. Pterin is a heterocyclic compound composed of a pteridine ring system (made up of a pyrazine fused to a pyrimidine), with a keto group and an amino group at the 2- and 4- positions, respectively.

External Descriptors

Not available

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