Compound Identification
SMILES
CC1=[N+](C=C2C3=C(C[C@@H](O3)C(C)(C)O)C=CC2=C1)[C@H](CC1=CC=C(O)C=C1)C([O-])=O
InChIKey
InChIKey=WSGSZRIQNWXHHN-NHCUHLMSSA-N
Formula
C24H25NO5
Mass
407.466
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 and derivatives Amphetamines and derivatives Isoquinolines and derivatives Coumarans 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Methylpyridines Pyridinium derivatives Tertiary alcohols Heteroaromatic compounds Carboxylic acid salts Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpropanoic-acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Isoquinoline - Coumaran - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Methylpyridine - Phenol - Monocyclic benzene moiety - Pyridine - Benzenoid - Pyridinium - Heteroaromatic compound - Tertiary alcohol - Carboxylic acid salt - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Oxacycle - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Alcohol - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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