Compound Identification
SMILES
[O-]C(=O)C(CC#C)C#N
InChIKey
InChIKey=LLKWSCRKKHQWCN-UHFFFAOYSA-M
Formula
C6H4NO2
Mass
122.104
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Branched 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
Branched fatty acids
Alternative Parents
Unsaturated fatty acids Carboxylic acid salts Nitriles Monocarboxylic acids and derivatives Carboxylic acids Acetylides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic anions
Molecular Framework
Aliphatic acyclic compounds
Substituents
Branched fatty acid - Unsaturated fatty acid - Carboxylic acid salt - Carboxylic acid derivative - Acetylide - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic anion - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as branched fatty acids. These are fatty acids containing a branched chain.
External Descriptors
Not available