Compound Identification
SMILES
CO\N=C(/C(=O)NC1CN2CC(C([O-])=O)=C(N2C1=O)C([O-])=O)C1=CSC(N)=N1
InChIKey
InChIKey=CYXBUIAANOKOEZ-LSCVHKIXSA-L
Formula
C14H12N6O7S
Mass
408.35
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
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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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
2,4-disubstituted thiazoles Pyrazolidinones 2-amino-1,3-thiazoles Dicarboxylic acids and derivatives Pyrazolines Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Carboxylic acid salts Carboxylic acid hydrazides Azacyclic compounds Carboxylic acids Primary amines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - 2,4-disubstituted 1,3-thiazole - Dicarboxylic acid or derivatives - Pyrazolidinone - 1,3-thiazol-2-amine - Azole - Pyrazolidine - Pyrazoline - Thiazole - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Carboxylic acid hydrazide - Carboxylic acid salt - Azacycle - Organoheterocyclic compound - Carboxylic acid - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Amine - Hydrocarbon derivative - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available