Compound Identification
SMILES
CC(=O)C(\CC([O-])=O)=C/C1=CC=CC=C1
InChIKey
InChIKey=BNQYXFAVUMPZFG-XFFZJAGNSA-M
Formula
C12H11O3
Mass
203.218
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
Gamma-keto acids and derivatives Benzene and substituted derivatives Alpha-branched alpha,beta-unsaturated ketones Enones Acryloyl compounds Ketones Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - Gamma-keto acid - Monocyclic benzene moiety - Keto acid - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Ketone - Carboxylic acid salt - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic anion - Aromatic homomonocyclic 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