Compound Identification
SMILES
[Na+].COC1=CC(OC)=CC(CCC(=O)C2=C(C)C=C(OP([O-])(=O)OC3=CC(C)=C(C=C3)C(=O)CCC3=CC(OC)=CC(OC)=C3)C=C2)=C1
InChIKey
InChIKey=KXCMDOXPAGKVRG-UHFFFAOYSA-M
Formula
C36H38NaO10P
Mass
684.654
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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
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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
Retro-dihydrochalcones
Alternative Parents
Alkyl-phenylketones Butyrophenones Aryl phosphodiesters Dimethoxybenzenes Phenoxy compounds Benzoyl derivatives Aryl alkyl ketones Anisoles Toluenes Alkyl aryl ethers Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Aryl phosphodiester - Butyrophenone - Aryl phosphate - Dimethoxybenzene - M-dimethoxybenzene - Phenylketone - Phenoxy compound - Aryl ketone - Methoxybenzene - Benzoyl - Anisole - Phenol ether - Aryl alkyl ketone - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Organic phosphoric acid derivative - Phosphoric acid ester - Benzenoid - Ketone - Ether - Organic alkali metal salt - Organic sodium salt - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic oxygen compound - 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