Compound Identification
SMILES
[Na+].CC1=CC=CC=C1OP([O-])(=O)OC1=CC=C(CCC(=O)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=SMFSAWLQDKYBNP-UHFFFAOYSA-M
Formula
C22H20NaO5P
Mass
418.361
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 Retro-dihydrochalcones
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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
Retro-dihydrochalcones
Alternative Parents
Alkyl-phenylketones Butyrophenones Aryl phosphodiesters Phenoxy compounds Benzoyl derivatives Aryl alkyl ketones Toluenes Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Butyrophenone - Aryl phosphodiester - Aryl phosphate - Phenylketone - Benzoyl - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Toluene - Monocyclic benzene moiety - Benzenoid - Phosphoric acid ester - Organic phosphoric acid derivative - Ketone - Organic alkali metal salt - Organic salt - Organic oxygen compound - Organooxygen compound - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available