Compound Identification
SMILES
COC(=O)[C@H](CS)N(CC1=CSC=C1)C(=O)[C@@H](N)CC(O)=O
InChIKey
InChIKey=PCMSUEQNZOJVTM-UWVGGRQHSA-N
Formula
C13H18N2O5S2
Mass
346.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Peptides
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
Aspartic acid and derivatives Alpha amino acid esters Alpha amino acid amides Cysteine and derivatives Dicarboxylic acids and derivatives N-acyl amines Methyl esters Heteroaromatic compounds Tertiary carboxylic acid amides Thiophenes Amino acids Alkylthiols Carboxylic acids Hydrocarbon derivatives Organic oxides Carbonyl compounds Organopnictogen compounds Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha peptide - Aspartic acid or derivatives - Alpha-amino acid ester - Cysteine or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - N-acyl-amine - Dicarboxylic acid or derivatives - Heteroaromatic compound - Tertiary carboxylic acid amide - Methyl ester - Thiophene - Amino acid - Amino acid or derivatives - Carboxylic acid ester - Carboxamide group - Alkylthiol - Carboxylic acid - Organoheterocyclic compound - Organic nitrogen compound - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic 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