Compound Identification
SMILES
O[N+]([O-])=O.CC(C)C(N)C(O)=O
InChIKey
InChIKey=DBBFFYXLECNESF-UHFFFAOYSA-N
Formula
C5H12N2O5
Mass
180.16
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Valine and derivatives
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Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Valine and derivatives
Alternative Parents
Alpha amino acids Nitro fatty acids Methyl-branched fatty acids Organic nitrates Organic nitro compounds Organic nitric acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic zwitterions Organic salts Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid - Nitro fatty acid - Branched fatty acid - Methyl-branched fatty acid - Fatty acyl - Fatty acid - Organic nitrate - Amino acid - Organic nitro compound - Organic nitric acid - Organic nitric acid or derivatives - Carboxylic acid - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Amine - Organic salt - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Primary aliphatic amine - Carbonyl group - Organooxygen compound - Primary amine - Organic oxygen compound - Organic zwitterion - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available