Compound Identification
SMILES
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)CC(CC1=CC=CC=C1)(C(O)=O)C(O)=O
InChIKey
InChIKey=SUXRWHBUBLAYQG-YOEHRIQHSA-N
Formula
C22H31NO7
Mass
421.49
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 Gamma-keto acids and derivatives Methyl-branched fatty acids Amino fatty acids Dicarboxylic acids and derivatives Benzene and substituted derivatives Carbamate esters Ketones Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Medium-chain keto acid - Gamma-keto acid - Amino fatty acid - Branched fatty acid - Methyl-branched fatty acid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Keto acid - Dicarboxylic acid or derivatives - Carbamic acid ester - Ketone - Carboxylic acid derivative - Carboxylic acid - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxide - Aromatic homomonocyclic 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