Compound Identification
SMILES
CS\C(O)=C\C(=O)\C=C\C1=CC=C(C)C=C1
InChIKey
InChIKey=DXVQVEFFVZRVEA-NJHPPEEMSA-N
Formula
C13H14O2S
Mass
234.31
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
Styrenes Toluenes Vinylogous thioesters Vinylogous acids Enones Acryloyl compounds Ketones Ketene acetals Sulfenyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - Styrene - Toluene - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Acryloyl-group - Enone - Vinylogous acid - Alpha,beta-unsaturated ketone - Ketone - Ketene acetal or derivatives - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - 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