EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:45003 - (2R,4S)-5,5-dimethyl-2-{(1R)-2-oxo-1-[(phenylacetyl)amino]ethyl}-1,3-thiazolidine-4-carboxylic acid

ChEBI IDCHEBI:45003
ChEBI Name(2R,4S)-5,5-dimethyl-2-{(1R)-2-oxo-1-[(phenylacetyl)amino]ethyl}-1,3-thiazolidine-4-carboxylic acid
Stars
ASCII Name(2R,4S)-5,5-dimethyl-2-{(1R)-2-oxo-1-[(phenylacetyl)amino]ethyl}-1,3-thiazolidine-4-carboxylic acid
Last Modified19 March 2008
DownloadsMolfile
FormulaC16H20N2O4S
Net Charge0
Average Mass336.413
Monoisotopic Mass336.11438
SMILES[H]OC(=O)[C@]1([H])N([H])[C@@]([H])([C@@]([H])(C([H])=O)N([H])C(=O)C([H])([H])c2c([H])c([H])c([H])c([H])c2[H])SC1(C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C16H20N2O4S/c1-16(2)13(15(21)22)18-14(23-16)11(9-19)17-12(20)8-10-6-4-3-5-7-10/h3-7,9,11,13-14,18H,8H2,1-2H3,(H,17,20)(H,21,22)/t11-,13+,14-/m1/s1
InChIKeyOGFZUTGOGYUTKZ-KWCYVHTRSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R,4S)-5,5-dimethyl-2-{(1R)-2-oxo-1-[(phenylacetyl)amino]ethyl}-1,3-thiazolidine-4-carboxylic acid (CHEBI:45003) is a monocarboxylic acid amide (CHEBI:29347)
(2R,4S)-5,5-dimethyl-2-{(1R)-2-oxo-1-[(phenylacetyl)amino]ethyl}-1,3-thiazolidine-4-carboxylic acid (CHEBI:45003) is a thiazolidinemonocarboxylic acid (CHEBI:48875)
Synonyms  Source
(2R,4S)-5,5-dimethyl-2-{(1R)-2-oxo-1-[(phenylacetyl)amino]ethyl}-1,3-thiazolidine-4-carboxylic acidPDBeChem
OPEN FORM - PENICILLIN GPDBeChem
Manual XrefsDatabases
PNMPDBeChem