Compound Identification
SMILES
[Ac].NCCCCC(NC(=O)[C@@H]1C[C@@H](O)C[N-]1)C(=O)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=VDDGMZDRFVORTJ-WEVUIEQMSA-N
Formula
C18H23AcN4O3S
Mass
602.47
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 Proline and derivatives
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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
Direct Parent
Proline and derivatives
Alternative Parents
Alpha amino acid amides Benzothiazoles Pyrrolidinecarboxamides Aryl alkyl ketones Benzenoids Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Organic anions
Molecular Framework
Not available
Substituents
Proline or derivatives - Alpha-amino acid amide - 1,3-benzothiazole - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Aryl ketone - Aryl alkyl ketone - Benzenoid - Azole - Pyrrolidine - Thiazole - Heteroaromatic compound - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Ketone - Organoheterocyclic compound - Azacycle - Amine - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Alcohol - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available