Compound Identification
SMILES
COC[C@H](C)OC1=CC(=CC(O[C@@H](C)CC2=CC=C(Cl)S2)=C1)C(=O)NC1=NC=C(C=C1)C(=O)OC
InChIKey
InChIKey=VCALIZWVYFAYCQ-HOTGVXAUSA-N
Formula
C25H27ClN2O6S
Mass
519.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
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Subclass
Pyridinecarboxylic acids and derivatives
- Level 5 Pyridinecarboxylic acids
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Subclass
Pyridinecarboxylic acids and derivatives
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids
Alternative Parents
Benzamides Phenoxy compounds Phenol ethers Benzoyl derivatives 2,5-disubstituted thiophenes Alkyl aryl ethers Aryl chlorides Imidolactams Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzamide - Benzoic acid or derivatives - Pyridine carboxylic acid - Phenoxy compound - Phenol ether - Benzoyl - Alkyl aryl ether - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Heteroaromatic compound - Methyl ester - Thiophene - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
External Descriptors
Not available