Compound Identification
SMILES
CC(C)[C@H](NC(=O)C1=NOC(C)=C1)C(=O)C[C@@H](CC1=CC=C(F)C=C1)C(O)=O
InChIKey
InChIKey=JFQOJCVRJLLFGZ-KDOFPFPSSA-N
Formula
C20H23FN2O5
Mass
390.411
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Phenylpropanoic acids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Phenylpropanoic acids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanoic acids
Alternative Parents
Medium-chain keto acids and derivatives 2-heteroaryl carboxamides Gamma-keto acids and derivatives Fluorobenzenes Halogenated fatty acids Heterocyclic fatty acids Methyl-branched fatty acids Aryl fluorides Heteroaromatic compounds Isoxazoles Secondary carboxylic acid amides Ketones Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpropanoic-acid - Medium-chain keto acid - 2-heteroaryl carboxamide - Gamma-keto acid - Heterocyclic fatty acid - Halogenated fatty acid - Halobenzene - Branched fatty acid - Methyl-branched fatty acid - Fluorobenzene - Keto acid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Isoxazole - Heteroaromatic compound - Azole - Carboxamide group - Secondary carboxylic acid amide - Ketone - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors
Not available