Compound Identification
SMILES
CON=C(C(O)=O)C(=O)C(C)Br
InChIKey
InChIKey=LWQRSEQZMHZWST-UHFFFAOYSA-N
Formula
C6H8BrNO4
Mass
238.037
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Halogenated fatty acids
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Subclass
Fatty acids and conjugates
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acids and conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Halogenated fatty acids
Alternative Parents
Short-chain keto acids and derivatives Methyl-branched fatty acids Beta-keto acids and derivatives Beta-hydroxy ketones Alpha-haloketones Oxime ethers Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Beta-keto acid - Branched fatty acid - Halogenated fatty acid - Methyl-branched fatty acid - Short-chain keto acid - Beta-hydroxy ketone - Keto acid - Alpha-haloketone - Oxime ether - Ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alkyl bromide - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Organohalogen compound - Organobromide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as halogenated fatty acids. These are fatty acids with a chain that carries a halogen atom (Cl,F,I,Br).
External Descriptors
Not available