Structure Information
Structure

Compound Identification

SMILES

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=DAIWUODYOZCRKF-JXLSVOJSSA-O

Formula

C31H31N6O7S2

Mass

663.74

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alkyl-phenylketone - N-acyl-alpha amino acid or derivatives - Phenylketone - Aryl thioether - Benzoyl - Aryl ketone - Aryl alkyl ketone - 2,4-disubstituted 1,3-thiazole - Alkylarylthioether - Monocyclic benzene moiety - Pyridine - Pyridinium - Benzenoid - 1,3-thiazol-2-amine - Azole - Beta-lactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Vinylogous ester - Azetidine - Secondary carboxylic acid amide - Carboxamide group - Ketone - Amino acid - Lactam - Thioether - Organoheterocyclic compound - Azacycle - Oxacycle - Sulfenyl compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Amine - Organic oxide - Primary amine - Hydrocarbon derivative - 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

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