Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C(NC2=NC(=CC(NCC3=CC=C(C=C3)S(N)(=O)=O)=N2)C(=O)NCC(O)=O)S1
InChIKey
InChIKey=KDSBPJNHWFFPRW-UHFFFAOYSA-N
Formula
C21H23N7O7S2
Mass
549.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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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
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
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Level 7
N-acyl-alpha amino acids and derivatives
-
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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Benzenesulfonamides Pyrimidinecarboxylic acids and derivatives Benzenesulfonyl compounds Thiazolecarboxylic acids and derivatives 2,4,5-trisubstituted thiazoles 2-heteroaryl carboxamides Benzylamines Aminopyrimidines and derivatives Organosulfonamides 2-amino-1,3-thiazoles Imidolactams Heteroaromatic compounds Aminosulfonyl compounds Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Amines Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha-amino acid - Benzenesulfonamide - Pyrimidine-6-carboxylic acid or derivatives - Benzenesulfonyl group - 2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Benzylamine - Aminopyrimidine - Pyrimidine - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Imidolactam - 1,3-thiazol-2-amine - Sulfonyl - Heteroaromatic compound - Thiazole - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Azole - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Carboxylic acid - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available