Compound Identification
SMILES
COC(=O)C(NC(=O)C1CC(CCN1C(=O)C1CCCN1)NC(=O)CSC)C(C)C
InChIKey
InChIKey=WCNOPNNQMHVTEJ-UHFFFAOYSA-N
Formula
C20H34N4O5S
Mass
442.58
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 Amino acids and derivatives
-
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
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Valine and derivatives Alpha amino acid esters Alpha amino acid amides Piperidinecarboxamides N-acylpiperidines Pyrrolidinecarboxamides Fatty acid esters Tertiary carboxylic acid amides Methyl esters Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Dialkylamines Monocarboxylic acids and derivatives Dialkylthioethers Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-acyl-piperidine - 2-piperidinecarboxamide - Piperidinecarboxamide - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Fatty acid ester - Fatty acyl - Piperidine - Methyl ester - Tertiary carboxylic acid amide - Pyrrolidine - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Secondary aliphatic amine - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Thioether - Secondary amine - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Aliphatic heteromonocyclic 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