Compound Identification
SMILES
OC(=O)C(=O)CC(=O)C=CC1=CC=CN1CC1=CC=CC=C1
InChIKey
InChIKey=PHOQCAGAUFCYHO-UHFFFAOYSA-N
Formula
C17H15NO4
Mass
297.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Keto acids and derivatives
Subclass
Medium-chain keto acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Medium-chain keto acids and derivatives
Alternative Parents
3-Acylpyruvic acids Amino fatty acids Heterocyclic fatty acids Beta-diketones Unsaturated fatty acids Substituted pyrroles Alpha-keto acids and derivatives Benzene and substituted derivatives Acryloyl compounds Alpha-hydroxy ketones Heteroaromatic compounds Enones Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Medium-chain keto acid - Gamma-keto acid - 3-acylpyruvic acid - Heterocyclic fatty acid - Amino fatty acid - 1,3-diketone - Alpha-keto acid - Substituted pyrrole - Unsaturated fatty acid - 1,3-dicarbonyl compound - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Alpha-hydroxy ketone - Pyrrole - Alpha,beta-unsaturated ketone - Enone - Heteroaromatic compound - Acryloyl-group - Ketone - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain keto acids and derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain.
External Descriptors
Not available