Structure Information
Structure

Compound Identification

SMILES

CC(C)(O\N=C(/C(=O)N[C@H]1[C@H](NC1=O)C(N)=O)C1=CSC(NC(=O)CCl)=N1)C(=O)OCC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=TWAYZRHNJXDJIN-MGEJSBKNSA-N

Formula

C22H22ClN7O9S

Mass

595.97

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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

Peptides

Direct Parent

Dipeptides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-dipeptide - Monobactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Nitrobenzene - Nitroaromatic compound - N-arylamide - 2,4-disubstituted 1,3-thiazole - Monocyclic benzene moiety - Benzenoid - Thiazole - Chloroacetamide - Azole - Heteroaromatic compound - Beta-lactam - Secondary carboxylic acid amide - Primary carboxylic acid amide - C-nitro compound - Organic nitro compound - Lactam - Carboxylic acid ester - Carboxamide group - Azetidine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxygen compound - Alkyl halide - Organic salt - Carbonyl group - Alkyl chloride - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organic oxide - Organochloride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.

External Descriptors

Not available

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