Compound Identification
SMILES
CC(C)(CC(CC([O-])=O)(CC(C)(C)[N+]([O-])=O)C([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=WIPGTSHJYRFDAI-UHFFFAOYSA-L
Formula
C12H18N2O8
Mass
318.283
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Nitro 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
Nitro fatty acids
Alternative Parents
Medium-chain fatty acids Methyl-branched fatty acids Dicarboxylic acids and derivatives Carboxylic acid salts C-nitro compounds Organic oxoazanium compounds Carboxylic acids Organonitrogen compounds Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Nitro fatty acid - Medium-chain fatty acid - Branched fatty acid - Methyl-branched fatty acid - Dicarboxylic acid or derivatives - Carboxylic acid salt - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Carboxylic acid - Organic oxoazanium - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as nitro fatty acids. These are fatty acids containing a nitro group.
External Descriptors
Not available