Compound Identification
SMILES
COC1=CC(C=CC(=O)SC2=CC=CC=C2)=CC(OC)=C1O
InChIKey
InChIKey=KNQMIFZBEXMHDV-UHFFFAOYSA-N
Formula
C17H16O4S
Mass
316.37
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
Methoxyphenols Dimethoxybenzenes Thiophenol esters Styrenes Phenoxy compounds Aryl thioethers Anisoles Alkyl aryl ethers Thioesters Carbothioic S-esters Sulfenyl compounds Carboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hydroxycinnamic acid or derivatives - Methoxyphenol - Dimethoxybenzene - M-dimethoxybenzene - Thiophenol ester - Aryl thioether - Methoxybenzene - Phenoxy compound - Anisole - Phenol ether - Styrene - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Carbothioic s-ester - Thiocarboxylic acid ester - Sulfenyl compound - Ether - Carboxylic acid derivative - Thiocarboxylic acid or derivatives - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic 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