Structure Information
Structure

Compound Identification

SMILES

CC(CC([N+]([O-])=O)([N+]([O-])=O)[N+]([O-])=O)C(O)=O

InChIKey

InChIKey=NJQDQWOQTDJLAO-UHFFFAOYSA-N

Formula

C5H7N3O8

Mass

237.124

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aliphatic acyclic compounds

Substituents

Nitro fatty acid - Branched fatty acid - Methyl-branched fatty acid - C-nitro compound - Ortho amide - Orthocarboxylic acid derivative - Organic nitro compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic salt - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - 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

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