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-M
Formula
C21H21O4
Mass
337.396
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
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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 Monocyclic monoterpenoids Aromatic monoterpenoids Phenylpropanes Cumenes Styrenes Phenoxy compounds Anisoles Methoxybenzenes Aryl ketones Benzoyl derivatives Alkyl aryl ethers Acryloyl compounds Enones Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Monocyclic monoterpenoid - Monoterpenoid - Aromatic monoterpenoid - P-cymene - Cumene - Phenylpropane - Methoxybenzene - Styrene - Phenol ether - Anisole - Aryl ketone - Phenoxy compound - Benzoyl - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Ketone - Carboxylic acid salt - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxygen compound - Organic oxide - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic anion - 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