Compound Identification
SMILES
COC1=C(C=C2C=CC(SC(C(O)CCCC(O)=O)C3=CC4=C(CCCC4)C=C3)=CC2=N1)C(O)=O
InChIKey
InChIKey=DBGYQGDLQAHVQU-UHFFFAOYSA-N
Formula
C27H29NO6S
Mass
495.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
- Subclass Quinoline carboxylic acids
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Class
Quinolines and derivatives
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Superclass
Organoheterocyclic compounds
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
Quinolones and derivatives Tetralins Pyridinecarboxylic acids Thiophenol ethers Medium-chain fatty acids Thia fatty acids Alkyl aryl ethers Alkylarylthioethers Heterocyclic fatty acids Hydroxy fatty acids Heteroaromatic compounds Secondary alcohols Carboxylic acids Azacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organonitrogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxylic acid - Quinolone - Tetralin - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Aryl thioether - Thiophenol ether - Medium-chain fatty acid - Alkylarylthioether - Thia fatty acid - Alkyl aryl ether - Heterocyclic fatty acid - Hydroxy fatty acid - Fatty acid - Benzenoid - Pyridine - Fatty acyl - Heteroaromatic compound - Secondary alcohol - Thioether - Sulfenyl compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Alcohol - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen 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