Compound Identification
SMILES
OC(C(F)CN=[N+]=[N-])C(O)=O
InChIKey
InChIKey=IBXQRBKCUZTKJE-UHFFFAOYSA-N
Formula
C4H6FN3O3
Mass
163.108
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
Hydroxy fatty acids Alpha hydroxy acids and derivatives Monosaccharides Secondary alcohols Azo compounds Azo imides Fluorohydrins Carboxylic acids Monocarboxylic acids and derivatives Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organofluorides Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Halogenated fatty acid - Hydroxy fatty acid - Alpha-hydroxy acid - Hydroxy acid - Monosaccharide - Azo compound - Azo imide - Fluorohydrin - Halohydrin - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organic oxygen compound - Alkyl fluoride - Organic salt - Organohalogen compound - Carbonyl group - Alcohol - Organofluoride - Organonitrogen compound - Organic cation - 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