Compound Identification
SMILES
COC1=C(CC(O)=O)C=C(C=C1)C(=O)\C=C\C1=CC=C(C=C1)C(C)C
InChIKey
InChIKey=QEZKJEQEROSPCU-UXBLZVDNSA-N
Formula
C21H22O4
Mass
338.403
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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Subclass
Chalcones and dihydrochalcones
-
Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
Retrochalcones
Alternative Parents
Cinnamic acids and derivatives Aromatic monoterpenoids Monocyclic monoterpenoids Phenylpropanes Cumenes Anisoles Styrenes Aryl ketones Benzoyl derivatives Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Acryloyl compounds Enones Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - P-cymene - Phenylpropane - Cumene - Aryl ketone - Phenoxy compound - Styrene - Phenol ether - Benzoyl - Methoxybenzene - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Ketone - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available