Compound Identification
SMILES
COC(=O)C(C(C)=O)=C1C(=O)OCC1(C)C
InChIKey
InChIKey=GOVDJEMXEHVFJE-UHFFFAOYSA-N
Formula
C11H14O5
Mass
226.228
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 Gamma butyrolactones Dicarboxylic acids and derivatives Oxolanes Methyl esters Enones Enoate esters Acryloyl compounds Ketones Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Beta-keto acid - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Gamma butyrolactone - Acryloyl-group - Enone - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Oxolane - Carboxylic acid ester - Ketone - Lactone - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic oxide - Aliphatic heteromonocyclic 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