Compound Identification
SMILES
COC1=CC(\C=C\C(=O)C2=C(C)NC(S2)=C2C=CC(=O)C=C2)=CC(OC)=C1O
InChIKey
InChIKey=ABBMJPHTLPNLCD-RUDMXATFSA-N
Formula
C21H19NO5S
Mass
397.45
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
Dimethoxybenzenes Methoxyphenols Anisoles P-quinomethanes Phenoxy compounds Styrenes Alkyl aryl ethers Enones Vinylogous amides Acryloyl compounds Thiazolines Thioenol ethers Ketene acetals Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydroxycinnamic acid or derivatives - Methoxyphenol - M-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - P-quinomethane - Methoxybenzene - Phenol ether - Quinomethane - Styrene - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Vinylogous amide - Alpha,beta-unsaturated ketone - Meta-thiazoline - Ketone - Cyclic ketone - Thioenolether - Ketene acetal or derivatives - Enamine - Azacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - 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