Compound Identification
SMILES
NC1=NC(=CS1)C(=N\OCC1=CC=CC=C1)\C(=O)NC1C2COC(CSC3=NN=CS3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=VVRKMFXXKLWQJY-MBTHVWNTSA-N
Formula
C22H19N7O6S3
Mass
573.62
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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 Alkylarylthioethers 2-amino-1,3-thiazoles Benzene and substituted derivatives Vinylogous esters Thiadiazoles Tertiary carboxylic acid amides Beta lactams Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - 1,3-thiazol-2-amine - Azole - Beta-lactam - Tertiary carboxylic acid amide - Thiadiazole - Thiazole - Vinylogous ester - Heteroaromatic compound - Azetidine - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Lactam - Sulfenyl compound - Thioether - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Primary amine - Amine - 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