Compound Identification
SMILES
CC(N)(C(O)C1=CC=CC=C1)C(O)=O
InChIKey
InChIKey=HMWXECPLLMSACH-UHFFFAOYSA-N
Formula
C10H13NO3
Mass
195.218
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
Alpha amino acids Phenylpropanes Beta hydroxy acids and derivatives Aralkylamines Secondary alcohols Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Alpha-amino acid - Alpha-amino acid or derivatives - Phenylpropane - Beta-hydroxy acid - Aralkylamine - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Secondary alcohol - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Primary aliphatic amine - Organic nitrogen compound - Aromatic alcohol - Organic oxygen compound - Carbonyl group - Organic oxide - Alcohol - Hydrocarbon derivative - Amine - Primary amine - Organonitrogen compound - Organooxygen compound - 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