Compound Identification
SMILES
C[C@](N)(C(O)C1=CC(O)=C(O)C=C1)C(O)=O
InChIKey
InChIKey=AARNSWZMXIAAJT-HTLJXXAVSA-N
Formula
C10H13NO5
Mass
227.216
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
D-alpha-amino acids Phenylpropanes Catechols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Aralkylamines Beta hydroxy acids and derivatives Secondary alcohols Amino acids Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Aromatic alcohols Monoalkylamines Organopnictogen compounds Carbonyl compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Alpha-amino acid - Alpha-amino acid or derivatives - D-alpha-amino acid - Phenylpropane - Catechol - 1-hydroxy-4-unsubstituted benzenoid - Beta-hydroxy acid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Hydroxy acid - Amino acid - Secondary alcohol - Amino acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Aromatic alcohol - Primary aliphatic amine - Organonitrogen compound - Alcohol - Organooxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Primary amine - Organic oxide - Hydrocarbon derivative - 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