Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H]1CSCC2=C(O)C=C(NC(C)=O)C=C2C(=O)OC[C@H](NC(O)=O)C(=O)N1

InChIKey

InChIKey=OKVYRFWAHDGUKO-STQMWFEESA-N

Formula

C18H21N3O9S

Mass

455.44

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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

Not available

Direct Parent

Peptides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha peptide - Alpha-amino acid ester - Macrolactam - Alpha-amino acid or derivatives - N-acetylarylamine - N-arylamide - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Methyl ester - Acetamide - Lactam - Carboxylic acid ester - Carbamic acid - Carboxamide group - Carbamic acid derivative - Lactone - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Monocarboxylic acid or derivatives - Thioether - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.

External Descriptors

Not available

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