Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(COC2=C(NC(=NC2=O)C2=C(NC(=O)CCC(=O)NO)C=CS2)C(O)=O)C=C1

InChIKey

InChIKey=NQZYSALHZDRZEA-UHFFFAOYSA-N

Formula

C21H20N4O8S

Mass

488.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Pyrimidinecarboxylic acids and derivatives

Direct Parent

Pyrimidinecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Hydropyrimidine carboxylic acid derivative - Pyrimidine-6-carboxylic acid - Anisole - Phenol ether - Phenoxy compound - N-arylamide - Methoxybenzene - Pyrimidone - Alkyl aryl ether - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Fatty amide - Hydropyrimidine - Heteroaromatic compound - Vinylogous amide - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Hydroxamic acid - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.

External Descriptors

Not available

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