Compound Identification
SMILES
[Br-].CCOC(=O)C[N+]1=C(C)C(=O)\C(=C\NNC2=NC=CC=N2)C(CO)=C1
InChIKey
InChIKey=VQYJSFGFIFAFIM-FTPOTTDRSA-N
Formula
C16H20BrN5O4
Mass
426.271
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
Dihydropyridines Pyrimidines and pyrimidine derivatives Vinylogous amides Heteroaromatic compounds Cyclic ketones Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Primary alcohols Organic oxides Organic bromide salts Hydrocarbon derivatives Hydrazines and derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Dihydropyridine - Hydropyridine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Ketone - Cyclic ketone - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Monocarboxylic acid or derivatives - Organic bromide salt - Organic salt - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrazine derivative - Organic oxygen compound - Alcohol - Carbonyl group - Organic cation - Aromatic heteromonocyclic 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