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CHEBI:41857 - (7S)-2-[(carboxycarbonyl)amino]-7-{[(1,1-dioxido-1,2-benzothiazol-3-yl)oxy]methyl}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid

ChEBI IDCHEBI:41857
ChEBI Name(7S)-2-[(carboxycarbonyl)amino]-7-{[(1,1-dioxido-1,2-benzothiazol-3-yl)oxy]methyl}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid
Stars
ASCII Name(7S)-2-[(carboxycarbonyl)amino]-7-{[(1,1-dioxido-1,2-benzothiazol-3-yl)oxy]methyl}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid
Last Modified16 May 2008
DownloadsMolfile
FormulaC18H14N2O9S2
Net Charge0
Average Mass466.449
Monoisotopic Mass466.01407
SMILES[H]OC(=O)C(=O)N([H])c1sc2c(c1C(=O)O[H])C([H])([H])C([H])([H])O[C@@]2([H])C([H])([H])OC1=NS(=O)(=O)c2c([H])c([H])c([H])c([H])c21
InChIInChI=1S/C18H14N2O9S2/c21-14(18(24)25)19-16-12(17(22)23)9-5-6-28-10(13(9)30-16)7-29-15-8-3-1-2-4-11(8)31(26,27)20-15/h1-4,10H,5-7H2,(H,19,21)(H,22,23)(H,24,25)/t10-/m0/s1
InChIKeyMDYIGSPVMWSFEZ-JTQLQIEISA-N
ChEBI Ontology
Outgoing Relation(s)
(7S)-2-[(carboxycarbonyl)amino]-7-{[(1,1-dioxido-1,2-benzothiazol-3-yl)oxy]methyl}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid (CHEBI:41857) is a benzothiazoles (CHEBI:37947)
(7S)-2-[(carboxycarbonyl)amino]-7-{[(1,1-dioxido-1,2-benzothiazol-3-yl)oxy]methyl}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid (CHEBI:41857) is a dicarboxylic acid (CHEBI:35692)
(7S)-2-[(carboxycarbonyl)amino]-7-{[(1,1-dioxido-1,2-benzothiazol-3-yl)oxy]methyl}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acid (CHEBI:41857) is a thienopyran (CHEBI:48910)
Synonyms  Source
7-(1,1-DIOXO-1H-BENZO[D]ISOTHIAZOL-3-YLOXYMETHYL)-2-(OXALYL-AMINO)-4,7-DIHYDRO-5H-THIENO[2,3-C]PYRAN-3-CARBOXYLIC ACIDPDBeChem
(7S)-2-[(carboxycarbonyl)amino]-7-{[(1,1-dioxido-1,2-benzisothiazol-3-yl)oxy]methyl}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylic acidPDBeChem
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