Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(COC(=O)N3CCN(CC3)C3=C(F)C=C4C(=O)C(=CN(C5CC5)C4=C3)C(O)=O)=C(N2C1=O)C(O)=O

InChIKey

InChIKey=OTKFKEXEFQNULP-ZSCXYPBFSA-N

Formula

C29H31FN4O9

Mass

598.584

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Quinolines and derivatives

Subclass

Quinoline carboxylic acids

Intermediate Tree Nodes

Not available

Direct Parent

Quinoline carboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Quinoline-3-carboxylic acid - N-arylpiperazine - Fluoroquinolone - Aminoquinoline - Dihydroquinolone - Haloquinoline - Carbapenem - Alpha-amino acid or derivatives - Dihydroquinoline - Piperazine-1-carboxylic acid - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Azepine - Piperazine - Benzenoid - Dicarboxylic acid or derivatives - 1,4-diazinane - Aryl halide - Pyridine - Aryl fluoride - Beta-lactam - Heteroaromatic compound - Vinylogous amide - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrroline - Secondary alcohol - Carbonic acid derivative - Lactam - Tertiary amine - Amino acid or derivatives - Amino acid - Azetidine - Carboxamide group - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Amine - Organic oxide - Organopnictogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as quinoline carboxylic acids. These are quinolines in which the quinoline ring system is substituted by a carboxyl group at one or more positions.

External Descriptors

Not available

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