Compound Identification
SMILES
COC(=O)CN1N=NN=C1C(NCCCN1C=CN=C1)C1=CC2=C(C=CC2N)C=C1
InChIKey
InChIKey=IMHGCAYJBCVMAC-UHFFFAOYSA-N
Formula
C20H24N8O2
Mass
408.466
Taxonomic Classification
Taxonomy Tree
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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
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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
Indenes and isoindenes Imidazolyl carboxylic acids and derivatives Aralkylamines N-substituted imidazoles Tetrazoles Methyl esters Heteroaromatic compounds Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Indene - Imidazolyl carboxylic acid derivative - Aralkylamine - N-substituted imidazole - Benzenoid - Azole - Imidazole - Tetrazole - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Secondary amine - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Primary amine - Primary aliphatic amine - Organic oxide - Organic oxygen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organooxygen 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