Compound Identification
SMILES
OS([O-])(=O)=O.NC1=NC(=CS1)C(=N\OC1CCCC1)\C(=O)N[C@H]1[C@H]2COC(CSC3=CC=[N+](CC(=O)C4=CC=CC=C4)C=C3)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=GJRSYIGDOVEFCG-DLTDFGAYSA-N
Formula
C31H32N6O11S3
Mass
760.81
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
Alkyl-phenylketones Aryl alkyl ketones Benzoyl derivatives 2,4-disubstituted thiazoles Alkylarylthioethers Pyridinium derivatives 2-amino-1,3-thiazoles Vinylogous esters Tertiary carboxylic acid amides Organic sulfuric acids and derivatives Heteroaromatic compounds Beta lactams Secondary carboxylic acid amides Amino acids Azetidines Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Primary amines Organic zwitterions Hydrocarbon derivatives Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alkyl-phenylketone - Phenylketone - Aryl ketone - Aryl thioether - Aryl alkyl ketone - Benzoyl - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Pyridine - Pyridinium - Benzenoid - Organic sulfuric acid or derivatives - Vinylogous ester - Tertiary carboxylic acid amide - Azole - Thiazole - Heteroaromatic compound - Beta-lactam - Azetidine - Amino acid - Carboxamide group - Ketone - Lactam - Secondary carboxylic acid amide - Thioether - Sulfenyl compound - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic salt - Organic zwitterion - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary 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