Compound Identification
SMILES
COC(=O)C(CCC(O)=O)(CC=C)[N+]([O-])=O
InChIKey
InChIKey=QEEKHOABHXUEDB-UHFFFAOYSA-N
Formula
C9H13NO6
Mass
231.204
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
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Nitro fatty acids Medium-chain fatty acids Branched fatty acids Fatty acid esters Unsaturated fatty acids Dicarboxylic acids and derivatives Methyl esters C-nitro compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Organic salts Organonitrogen compounds Carbonyl compounds Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Alpha-amino acid or derivatives - Nitro fatty acid - Medium-chain fatty acid - Branched fatty acid - Fatty acid ester - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Fatty acyl - Methyl ester - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid - Organic oxoazanium - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available