Compound Identification
SMILES
[Na+].CC(O)[C@@H]1[C@H]2SC(=C(N2C1=O)C([O-])=O)C1=CC(=CC=C1)C(N)=O
InChIKey
InChIKey=QQDXJYJBIIUMDP-ZTHILIETSA-M
Formula
C15H13N2NaO5S
Mass
356.33
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
Alpha amino acids and derivatives Benzamides Benzoyl derivatives Penems Thiazolecarboxylic acids and derivatives Vinylogous thioesters Tertiary carboxylic acid amides Thiazolines Secondary alcohols Primary carboxylic acid amides Azetidines Carboxylic acid salts Thioenol ethers Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid - Alpha-amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Penem - Thiazolecarboxylic acid or derivatives - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Beta-lactam - Tertiary carboxylic acid amide - Thiazole - Meta-thiazoline - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Primary carboxylic acid amide - Secondary alcohol - Thioenolether - Hemithioaminal - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Organic alkali metal salt - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic sodium salt - Alcohol - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic salt - Organic zwitterion - Organooxygen compound - Aromatic heteropolycyclic 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