Compound Identification
SMILES
OC(=O)C(C(=O)C=CC1=CC(O)=C(O)C=C1)=C1SCCS1
InChIKey
InChIKey=JPMOZYCGKJBEAK-UHFFFAOYSA-N
Formula
C14H12O5S2
Mass
324.37
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Hydroxycinnamic acids and derivatives
Alternative Parents
Medium-chain keto acids and derivatives Catechols Styrenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Beta-keto acids and derivatives Heterocyclic fatty acids Hydroxy fatty acids Vinylogous thioesters Beta-hydroxy ketones Unsaturated fatty acids Acryloyl compounds Enones 1,3-dithiolanes Ketene acetals Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydroxycinnamic acid or derivatives - Medium-chain keto acid - Catechol - Styrene - Beta-keto acid - Heterocyclic fatty acid - Hydroxy fatty acid - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Beta-hydroxy ketone - Vinylogous thioester - Fatty acyl - Keto acid - Benzenoid - Unsaturated fatty acid - 1,3-dithiolane - Enone - Dithiolane - Acryloyl-group - Alpha,beta-unsaturated ketone - Ketone - Ketene acetal or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxide - Organic oxygen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxycinnamic acids and derivatives. These are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated.
External Descriptors
Not available