Structure Information
Structure

Compound Identification

SMILES

CC(=O)N[C@@H](CSC(=O)OC(C)(C)C)C(=O)NCCO[N+]([O-])=O

InChIKey

InChIKey=NWIFVLXXMHHCLD-VIFPVBQESA-N

Formula

C12H21N3O7S

Mass

351.37

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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

Aliphatic acyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Cysteine or derivatives - Monothioacetal - Organic nitrate - Acetamide - Alkyl nitrate - Organic nitro compound - Carboxamide group - Organic nitric acid or derivatives - Secondary carboxylic acid amide - Thiocarbonic acid derivative - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Organic salt - Carbonyl group - Hydrocarbon derivative - Aliphatic acyclic 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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