Compound Identification
SMILES
CCOC(=O)C(=O)CBr.CCC(Br)C(=O)C(O)=O
InChIKey
InChIKey=NQYBJEFZJLCCFI-UHFFFAOYSA-N
Formula
C10H14Br2O6
Mass
390.024
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
-
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 Alpha-keto acids and derivatives Alpha-hydroxy ketones Alpha-haloketones Carboxylic acid esters Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Not available
Substituents
Branched fatty acid - Halogenated fatty acid - Short-chain keto acid - Methyl-branched fatty acid - Alpha-keto acid - Keto acid - Alpha-hydroxy ketone - Alpha-haloketone - Carboxylic acid ester - Ketone - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Alkyl bromide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organobromide - Organooxygen compound - Alkyl halide - Organohalogen compound - 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