Compound Identification
SMILES
COC(=O)CN1C(=NC2=C1C(=O)N(C)C(=O)N2C)N1C=CN=C1
InChIKey
InChIKey=KAFOAVSWXDPFOR-UHFFFAOYSA-N
Formula
C13H14N6O4
Mass
318.293
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 Alpha amino acid esters
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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
Alpha amino acid esters
Alternative Parents
Xanthines 6-oxopurines Alkaloids and derivatives Imidazolyl carboxylic acids and derivatives Pyrimidones N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Methyl esters Ureas Lactams Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Xanthine - 6-oxopurine - Purinone - Imidazopyrimidine - Purine - Alkaloid or derivatives - Imidazolyl carboxylic acid derivative - Pyrimidone - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Methyl ester - Azole - Imidazole - Urea - Carboxylic acid ester - Lactam - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available