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CHEBI:39788 - (2S,3R)-3-ethyl-1-[(4-methylphenyl)sulfonyl]-4-oxoazetidine-2-carboxylic acid

ChEBI IDCHEBI:39788
ChEBI Name(2S,3R)-3-ethyl-1-[(4-methylphenyl)sulfonyl]-4-oxoazetidine-2-carboxylic acid
Stars
ASCII Name(2S,3R)-3-ethyl-1-[(4-methylphenyl)sulfonyl]-4-oxoazetidine-2-carboxylic acid
Last Modified17 October 2009
DownloadsMolfile
FormulaC13H15NO5S
Net Charge0
Average Mass297.332
Monoisotopic Mass297.06709
SMILES[H]OC(=O)[C@@]1([H])N(S(=O)(=O)c2c([H])c([H])c(C([H])([H])[H])c([H])c2[H])C(=O)[C@]1([H])C([H])([H])C([H])([H])[H]
InChIInChI=1S/C13H15NO5S/c1-3-10-11(13(16)17)14(12(10)15)20(18,19)9-6-4-8(2)5-7-9/h4-7,10-11H,3H2,1-2H3,(H,16,17)/t10-,11+/m1/s1
InChIKeyQWRJBKGTEVHFRI-MNOVXSKESA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3R)-3-ethyl-1-[(4-methylphenyl)sulfonyl]-4-oxoazetidine-2-carboxylic acid (CHEBI:39788) is a N-acylazetidine (CHEBI:46959)
(2S,3R)-3-ethyl-1-[(4-methylphenyl)sulfonyl]-4-oxoazetidine-2-carboxylic acid (CHEBI:39788) is a azetidinecarboxylic acid (CHEBI:46891)
(2S,3R)-3-ethyl-1-[(4-methylphenyl)sulfonyl]-4-oxoazetidine-2-carboxylic acid (CHEBI:39788) is a sulfonamide (CHEBI:35358)
Synonyms  Source
(3S, 4R)-1-TOLUENESULPHONYL-3-ETHYL-AZETIDIN-2-ONE-4-CARBOXYLIC ACIDPDBeChem
(2S,3R)-3-ethyl-1-[(4-methylphenyl)sulfonyl]-4-oxoazetidine-2-carboxylic acidPDBeChem
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