Compound Identification
SMILES
CCCC1=CC=CC(\C=C\C(=O)[C@H]2C[C@@H]2C(=O)OCC)=C1
InChIKey
InChIKey=JSWBVRXOMYDLMV-IGXNXKSNSA-N
Formula
C18H22O3
Mass
286.371
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
Phenylpropanes Styrenes Gamma-keto acids and derivatives Cyclopropanecarboxylic acids and derivatives Enones Acryloyl compounds Ketones Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenylpropane - Gamma-keto acid - Styrene - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Keto acid - Benzenoid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - 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