Compound Identification
SMILES
[Fe].CC(=O)[C-]1C=CC=C1.CC1=CC=C(\C=C\C(=O)[C-]2[CH-][CH-][CH-][CH-]2)C=C1
InChIKey
InChIKey=BHGOZRUXXZQYMO-BGNBUWATSA-N
Formula
C22H20FeO2
Mass
372.248
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Styrenes Aryl alkyl ketones Toluenes Enones Acryloyl compounds Organic transition metal salts Enolates Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Not available
Substituents
Cinnamic acid or derivatives - Styrene - Aryl ketone - Aryl alkyl ketone - Toluene - Benzenoid - Monocyclic benzene moiety - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Ketone - Organic transition metal salt - Enolate - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Organic anion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available