Compound Identification
SMILES
C[C@@H]1O[C@@H]2[C@H](NC(=O)C(=N\OC(C)(C)C(O)=O)\C3=CSC(N)=N3)C(=O)N2C(C(O)=O)=C1CSC1=CC=[N+](C)C=C1
InChIKey
InChIKey=AXPAGQFNDQXHIX-SHEAVQNQSA-O
Formula
C24H27N6O8S2
Mass
591.63
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
Oxacephems 2,4-disubstituted thiazoles Alkylarylthioethers N-methylpyridinium compounds Pyridinium derivatives 2-amino-1,3-thiazoles Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azetidines Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Primary amines Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Oxacephem - Aryl thioether - 2,4-disubstituted 1,3-thiazole - N-methylpyridinium - Alkylarylthioether - Dicarboxylic acid or derivatives - Pyridine - 1,3-thiazol-2-amine - Pyridinium - Azole - Beta-lactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Azetidine - Carboxamide group - Amino acid - Lactam - Secondary carboxylic acid amide - Azacycle - Thioether - Oxacycle - Sulfenyl compound - Organoheterocyclic compound - Carboxylic acid - Primary amine - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Amine - Carbonyl group - Organic oxide - Organooxygen compound - Organic oxygen compound - Organic cation - 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