Compound Identification
SMILES
OC(=O)C(SC(=CC1=CC=CC=C1)C(O)=O)=CC1=CC=CC=C1
InChIKey
InChIKey=KMSXJPWCPOMFNB-UHFFFAOYSA-N
Formula
C18H14O4S
Mass
326.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acids
-
Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acids
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids
Alternative Parents
Thiodiacetic acid derivatives Benzene and substituted derivatives Thioenol ethers Sulfenyl compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid - Thiodiacetic_acid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Thioenolether - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available