Compound Identification
SMILES
CCCC(=N)C(C(O)=O)C1=C(Cl)N=C(C(N)=N1)[N+]([O-])=O
InChIKey
InChIKey=NNOQKPYYCZWHDJ-UHFFFAOYSA-N
Formula
C10H12ClN5O4
Mass
301.69
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Medium-chain 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
Medium-chain fatty acids
Alternative Parents
Nitroaromatic compounds Aminopyrazines Halogenated fatty acids Heterocyclic fatty acids Aryl chlorides Imidolactams Heteroaromatic compounds Amino acids Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids Organic oxoazanium compounds Monocarboxylic acids and derivatives Organic zwitterions Organochlorides Organic salts Primary amines Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitroaromatic compound - Medium-chain fatty acid - Aminopyrazine - Halogenated fatty acid - Heterocyclic fatty acid - Aryl chloride - Aryl halide - Pyrazine - Imidolactam - Heteroaromatic compound - Organic nitro compound - Amino acid or derivatives - Ketimine - C-nitro compound - Amino acid - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Carbonyl group - Organic salt - Amine - Imine - Organic oxide - Organic oxygen compound - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
External Descriptors
Not available