Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(COC2=CN=C(C=C2OCC2=CC=C(OC)C=C2)C(=O)OCC2=C(N3[C@H](SC2)[C@H](N)C3=O)C(O)=O)C=C1

InChIKey

InChIKey=QNNGKBTVTIWLFG-LEAFIULHSA-N

Formula

C30H29N3O9S

Mass

607.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Pyridinecarboxylic acids and derivatives

Intermediate Tree Nodes

Pyridinecarboxylic acids - Pyridine-2-carboxylic acids

Direct Parent

5-alkoxy-2-carboxypyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-alkoxy-2-carboxypyrimidine - Alpha-amino acid or derivatives - Cephem - Phenol ether - Methoxybenzene - Anisole - Phenoxy compound - Alkyl aryl ether - Meta-thiazine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Beta-lactam - Tertiary carboxylic acid amide - Carboxylic acid ester - Azetidine - Carboxamide group - Amino acid or derivatives - Amino acid - Lactam - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Amine - Organic oxide - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 5-alkoxy-2-carboxypyrimidines. These are pyrimidine-2-carboxylic acids that carry an alkoxy substituent at the 5-position of the pyridine ring.

External Descriptors

Not available

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