Compound Identification
SMILES
CN1C(=O)[C@@](O)(CC(=O)C=C(O)C2=CC=CC=C2)C2=CC=CC=C12
InChIKey
InChIKey=VNKCEBWJFQGKMQ-LJQANCHMSA-N
Formula
C19H17NO4
Mass
323.348
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Indoles and derivatives Styrenes b'-hydroxy-alpha,beta-unsaturated ketones Beta-hydroxy ketones Vinylogous acids Tertiary carboxylic acid amides Acryloyl compounds Tertiary alcohols Enones Tertiary amines Amino acids and derivatives Lactams Enols Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Indole or derivatives - Styrene - B'-hydroxy-alpha,beta-unsaturated-ketone - Monocyclic benzene moiety - Beta-hydroxy ketone - Benzenoid - Acryloyl-group - Enone - Vinylogous acid - Alpha,beta-unsaturated ketone - Tertiary carboxylic acid amide - Tertiary alcohol - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Tertiary amine - Organoheterocyclic compound - Azacycle - Enol - Carboxylic acid derivative - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available