Compound Identification
SMILES
C[C@@H](O)[C@@H]1[C@H]2SC(CN3C[C@@H](C[C@H]3C(N)=O)OC(N)=O)=C(N2C1=O)C(=O)OCC=C
InChIKey
InChIKey=VWQUPWMRONLSRV-KHISEXDSSA-N
Formula
C18H24N4O7S
Mass
440.47
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 Penems Pyrrolidinecarboxamides Thiazolecarboxylic acids and derivatives Vinylogous thioesters N-alkylpyrrolidines Thiazolines Tertiary carboxylic acid amides Carbamate esters Enoate esters Azetidines Secondary alcohols Trialkylamines Primary carboxylic acid amides Thioenol ethers Azacyclic compounds Thiohemiaminal derivatives Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - Penem - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Thiazolecarboxylic acid or derivatives - Vinylogous thioester - N-alkylpyrrolidine - Beta-lactam - Pyrrolidine - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carbamic acid ester - Tertiary carboxylic acid amide - Thiazole - Meta-thiazoline - Azetidine - Carboxamide group - Carboxylic acid ester - Lactam - Primary carboxylic acid amide - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Thioenolether - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Hemithioaminal - Organic oxide - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aliphatic 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