Compound Identification
SMILES
[Na+].[Fe++].[CH]1[CH][CH][CH][CH]1.C[C@@H](O)[C@@H]1[C@H]2SC(=C(N2C1=O)C([O-])=O)C1=CC=C(C=C1)[C]1[CH][CH][CH][CH]1
InChIKey
InChIKey=DYDHULLKALRSLZ-PTSPVKKRSA-M
Formula
C24H20FeNNaO4S
Mass
497.32
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 Thiazolecarboxylic acids and derivatives Penems Vinylogous thioesters Benzene and substituted derivatives Thiazolines Tertiary carboxylic acid amides Azetidines Thioenol ethers Secondary alcohols Carboxylic acid salts Azacyclic compounds Thiohemiaminal derivatives Carboxylic acids Cycloalkenes Monocarboxylic acids and derivatives Organic transition metal salts Organopnictogen compounds Unsaturated aliphatic hydrocarbons Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic sodium salts Organonitrogen compounds Organic cations
Molecular Framework
Not available
Substituents
Cinnamic acid - Alpha-amino acid or derivatives - Penem - Thiazolecarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Vinylogous thioester - Beta-lactam - Tertiary carboxylic acid amide - Thiazole - Meta-thiazoline - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Secondary alcohol - Thioenolether - Azacycle - Organic alkali metal salt - Organic transition metal salt - Carboxylic acid derivative - Carboxylic acid - Cyclic olefin - Cycloalkene - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Hemithioaminal - Organic nitrogen compound - Unsaturated aliphatic hydrocarbon - Organic salt - Hydrocarbon derivative - Organic sodium salt - Carbonyl group - Organic oxide - Organic oxygen compound - Alcohol - Olefin - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Unsaturated hydrocarbon - Hydrocarbon - Organic cation - 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