Compound Identification
SMILES
[Cu++].CCOC(=O)C(C(C)=O)C(C)=O.CCOC(=O)C(=C(/C)[O-])\C(C)=O
InChIKey
InChIKey=VNOHIZMMMYQMKU-WVKUUHRJSA-M
Formula
C16H23CuO8
Mass
406.897
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Keto acids and derivatives
- Subclass Beta-keto acids and derivatives
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Class
Keto acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Keto acids and derivatives
Subclass
Beta-keto acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Beta-keto acids and derivatives
Alternative Parents
Fatty acid esters Beta-diketones Alpha-branched alpha,beta-unsaturated ketones Vinylogous acids Enones Enoate esters Acryloyl compounds Ketones Monocarboxylic acids and derivatives Enolates Organic oxides Organic copper salts Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Beta-keto acid - Fatty acid ester - 1,3-diketone - Fatty acyl - Alpha-branched alpha,beta-unsaturated-ketone - 1,3-dicarbonyl compound - Acryloyl-group - Enone - Vinylogous acid - Alpha,beta-unsaturated ketone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Enolate - Organic transition metal salt - Monocarboxylic acid or derivatives - Organic oxide - Organic copper salt - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Carbonyl group - Organooxygen compound - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.
External Descriptors
Not available