Structure Information
Structure

Compound Identification

SMILES

CC1SC[C@H]2[C@@H](NC(=O)COC3=CC=CC=C3)C(=O)N2C1(O)C(O)=O

InChIKey

InChIKey=VABJMOOPYKRVLE-CKPMOHCVSA-N

Formula

C16H18N2O6S

Mass

366.39

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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

N-acyl-alpha amino acid or derivatives - Thiomorpholine-3-carboxylic acid - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Alpha-hydroxy acid - Hydroxy acid - 1,4-thiazinane - Benzenoid - Tertiary carboxylic acid amide - Beta-lactam - Amino acid - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Azetidine - Lactam - Thioether - Dialkylthioether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid - Alkanolamine - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - 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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