Compound Identification
SMILES
[Na+].COC1=C(O)C=C(C=C1)C(=O)CC(=O)C1=C(O)C=CC(=C1)C([O-])=O
InChIKey
InChIKey=MNZUISNAMPLQQG-UHFFFAOYSA-M
Formula
C17H13NaO7
Mass
352.274
Taxonomic Classification
Taxonomy Tree
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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
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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
2'-Hydroxy-dihydrochalcones Cinnamylphenols Alkyl-phenylketones Butyrophenones Methoxyphenols Hydroxybenzoic acid derivatives Benzoic acids Phenoxy compounds Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Beta-diketones Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Carboxylic acid salts Carboxylic acids Organic oxides Organic sodium salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
2'-hydroxy-dihydrochalcone - Retro-dihydrochalcone - Cinnamylphenol - Alkyl-phenylketone - Butyrophenone - Hydroxybenzoic acid - Methoxyphenol - Phenylketone - Benzoic acid - Benzoic acid or derivatives - Methoxybenzene - Phenol ether - Anisole - Phenoxy compound - Aryl ketone - Aryl alkyl ketone - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - 1,3-diketone - Benzenoid - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Vinylogous acid - Carboxylic acid salt - Ketone - Organic alkali metal salt - Carboxylic acid derivative - Carboxylic acid - Ether - Organic salt - Organic sodium salt - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - 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