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CHEBI:141059 - (S)-2,5,5-trimethylthiazolidine-4-carboxylic acid

ChEBI IDCHEBI:141059
ChEBI Name(S)-2,5,5-trimethylthiazolidine-4-carboxylic acid
Stars
ASCII Name(S)-2,5,5-trimethylthiazolidine-4-carboxylic acid
DefinitionA trimethyl-substituted thiazolidine carboxylic acid derived by cleavage of and loss of C=O from the azetidine ring of penicillanic acid.
Last Modified24 November 2014
DownloadsMolfile
FormulaC7H13NO2S
Net Charge0
Average Mass175.253
Monoisotopic Mass175.06670
SMILESCC1N[C@@H](C(=O)O)C(C)(C)S1
InChIInChI=1S/C7H13NO2S/c1-4-8-5(6(9)10)7(2,3)11-4/h4-5,8H,1-3H3,(H,9,10)/t4?,5-/m0/s1
InChIKeyMQQSPQRNCBFBSG-AKGZTFGVSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(S)-2,5,5-trimethylthiazolidine-4-carboxylic acid (CHEBI:141059) has functional parent penicillanic acid (CHEBI:37806)
(S)-2,5,5-trimethylthiazolidine-4-carboxylic acid (CHEBI:141059) is a monocarboxylic acid (CHEBI:25384)
(S)-2,5,5-trimethylthiazolidine-4-carboxylic acid (CHEBI:141059) is a thiazolidines (CHEBI:35622)
IUPAC Name 
(4S)-2,5,5-trimethyl-1,3-thiazolidine-4-carboxylic acid
Synonym  Source
(S)-2,5,5-Trimethyl-thiazolidine-4-carboxylic acidChEMBL
Registry NumbersSources
Reaxys:4462Reaxys
Citations