Compound Identification
SMILES
CC(=O)C1=NC(CO)C(=O)N(N1)C1=CC=CC=C1
InChIKey
InChIKey=REHWTTAHTOOVQL-UHFFFAOYSA-N
Formula
C12H13N3O3
Mass
247.254
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
Triazinones Imidolactams Benzene and substituted derivatives 1,2,4-triazines Ketones Carboxylic acid hydrazides Amidrazones Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Amidines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Triazinone - Monocyclic benzene moiety - Triazine - Benzenoid - Imidolactam - 1,2,4-triazine - Carboxylic acid amidrazone - Carboxylic acid hydrazide - Ketone - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Azacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Primary alcohol - Organic nitrogen compound - Carbonyl group - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic 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