Compound Identification
SMILES
COC(=O)[C@]1(N(CC(=S)C1=S)C(=O)CN1CCCC1=O)C(=O)[C@@H]1CCCN1
InChIKey
InChIKey=LUPSQYFLFBUDKJ-BTDLBPIBSA-N
Formula
C17H21N3O5S2
Mass
411.49
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
-
Level 6
Alpha amino acids and derivatives
-
Level 7
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
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Level 7
N-acyl-alpha amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
-
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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Alpha amino acid esters Pyrrolidine carboxylic acids N-acylpyrrolidines Beta-keto acids and derivatives Fatty acid esters Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Alpha-amino ketones Methyl esters Thioketones Lactams Monocarboxylic acids and derivatives Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-alpha-amino acid - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Beta-keto acid - Fatty acid ester - Keto acid - Fatty acyl - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Alpha-aminoketone - Methyl ester - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Thioketone - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Secondary aliphatic amine - Secondary amine - Organic oxide - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Thiocarbonyl group - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available