Compound Identification
SMILES
COC1N(CC(O)C(O)C(O)C(O)CO)C2=C(C(=O)C1(OC)C(O)=O)C(CC1=CN=C(N)N=C1N)=C(C=C2)C#CC1=CC=CC=C1
InChIKey
InChIKey=XHHIGLUXWACPBA-UHFFFAOYSA-N
Formula
C31H35N5O10
Mass
637.646
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
Hydroquinolones Hydroquinolines Aryl alkyl ketones Dialkylarylamines Aminopyrimidines and derivatives Benzene and substituted derivatives Monosaccharides Imidolactams Vinylogous amides Heteroaromatic compounds Secondary alcohols Amino acids Polyols Azacyclic compounds Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Primary amines Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxylic acid - Quinolone - Tetrahydroquinolone - Tetrahydroquinoline - Aryl ketone - Aryl alkyl ketone - Dialkylarylamine - Aminopyrimidine - Monosaccharide - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Imidolactam - Heteroaromatic compound - Vinylogous amide - Secondary alcohol - Amino acid or derivatives - Amino acid - Ketone - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Azacycle - Monocarboxylic acid or derivatives - Polyol - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Alcohol - Primary amine - Organic oxide - Primary alcohol - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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