Compound Identification
SMILES
COC(=O)C1CCCN1C(=O)C1CC(CCN1C(=O)COCC(O)=O)NS(=O)(=O)C1=CN(C)C=N1
InChIKey
InChIKey=NQJDCTYQHWHWDW-UHFFFAOYSA-N
Formula
C20H29N5O9S
Mass
515.54
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
Proline and derivatives Alpha amino acid esters Alpha amino acid amides Piperidinecarboxamides N-acylpiperidines Pyrrolidine carboxylic acids N-acylpyrrolidines Organosulfonamides N-substituted imidazoles Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Methyl esters Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Carboxylic acids Dialkyl ethers Organonitrogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Proline or derivatives - N-acyl-alpha-amino acid - Alpha-amino acid amide - N-acyl-piperidine - 2-piperidinecarboxamide - Piperidinecarboxamide - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Dicarboxylic acid or derivatives - N-substituted imidazole - Piperidine - Organosulfonic acid amide - Azole - Imidazole - Heteroaromatic compound - Methyl ester - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Pyrrolidine - Organic sulfonic acid or derivatives - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid - Dialkyl ether - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Aromatic 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