EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:94618 - (4R)-3-[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]-4-thiazolidinecarboxylic acid

ChEBI IDCHEBI:94618
ChEBI Name(4R)-3-[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]-4-thiazolidinecarboxylic acid
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC9H12N2O4S
Net Charge0
Average Mass244.272
Monoisotopic Mass244.05178
SMILESO=C1CC[C@@H](C(=O)N2CSC[C@H]2C(=O)O)N1
InChIInChI=1S/C9H12N2O4S/c12-7-2-1-5(10-7)8(13)11-4-16-3-6(11)9(14)15/h5-6H,1-4H2,(H,10,12)(H,14,15)/t5-,6-/m0/s1
InChIKeyUUTKICFRNVKFRG-WDSKDSINSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(4R)-3-[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]-4-thiazolidinecarboxylic acid (CHEBI:94618) is a peptide (CHEBI:16670)
Synonyms  Source
adimodDrugCentral
pigitilDrugCentral
polimodDrugCentral
Manual XrefsDatabases
2164DrugCentral
LSM-5556LINCS
Registry NumbersSources
CAS:121808-62-6DrugCentral