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cis-5,6-3-[(trans-2-acetamidovinyl)sulfinyl]-6-(1-hydroxy-1-methylethyl)-7-oxo-1-azabicyclo[3,2,o]hept-2-ene-2-carboxylic acid, monosodium salt, hydrate

Compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

cis-5,6-3-[(trans-2-acetamidovinyl)sulfinyl]-6-(1-hydroxy-1-methylethyl)-7-oxo-1-azabicyclo[3,2,o]hept-2-ene-2-carboxylic acid, monosodium salt, hydrate
SpectraBase Compound ID EImr5omYD4G
InChI InChI=1S/C14H18N2O6S.Na.H2O/c1-7(17)15-4-5-23(22)9-6-8-10(14(2,3)21)12(18)16(8)11(9)13(19)20;;/h4-5,8,10,21H,6H2,1-3H3,(H,15,17)(H,19,20);;1H2/q;+1;/p-1/b5-4+;;/t8-,10+,23?;;/m1../s1
InChIKey PMLBGTJXOCCECC-AXGXETKISA-M
Mol Weight 382.36276928 g/mol
Molecular Formula C14H19N2NaO7S
Exact Mass 382.081066 g/mol
Parent InChIKey PFMRPXNTTSEESV-BISRQADZSA-M
Enantiomer InChIKey PMLBGTJXOCCECC-ANBNNZQISA-M

View Spectrum of cis-5,6-3-[(trans-2-acetamidovinyl)sulfinyl]-6-(1-hydroxy-1-methylethyl)-7-oxo-1-azabicyclo[3,2,o]hept-2-ene-2-carboxylic acid, monosodium salt, hydrate

1H NMR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Polysol-d

View Spectrum of cis-5,6-3-[(trans-2-acetamidovinyl)sulfinyl]-6-(1-hydroxy-1-methylethyl)-7-oxo-1-azabicyclo[3,2,o]hept-2-ene-2-carboxylic acid, monosodium salt, hydrate

FTIR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample S. Harada, Takeda Chemical Industries, Ltd., Osaka, Japan
Technique KBr WAFER

View Spectrum of cis-5,6-3-[(trans-2-acetamidovinyl)sulfinyl]-6-(1-hydroxy-1-methylethyl)-7-oxo-1-azabicyclo[3,2,o]hept-2-ene-2-carboxylic acid, monosodium salt, hydrate

UV-Vis Spectrum
Copyright Copyright © 2008-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol
  • cis-5,6-3-[(trans-2-ACETAMIDOVINYL)SULFINYL]-6-(1-HYDROXY-1-METHYLETHYL)-7-OXO-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID, MONOSODIUM SALT, HYDRATE
  • 1-AZABICYCLO/3.2.0/HEPT-2-ENE- 2-CARBOXYLIC ACID, CIS-5,6-3-//TRANS- 2-ACETAMIDOVINYL/SULFINYL/-6-/1-HYD- ROXY-1-METHYLETHYL/-7-OXO-, MONOSODIUM SALT, HYDRATE
PKNXCCLKZKJWNR-RXVVDRJESA-N
Compound-#13J
5'-O-[N-(BENZYLOXYCARBONYL)-VALYLPROLYLVALYL]-2'-DEOXY-5-[2-(PARA-PENTYLPHENYL)-ETHYL]-URIDINE
#17;(1R*,5R*,7S*,9R*,10R*)-9-TERT.-BUTYLDIMETHYLSILYLOXY-1-METHYL-5-PENTYL-6,11,2'-TRIOXASPIROBICYCLO-[5.4.0]-UNDECANE-10,1'-CYCLOPENT-4'-ENE-3'-ONE
(1R,2R,6S,7R,9R)-8-[(S)-1-Phenylethyl]-3,5-dioxa-8-azatricyclo[5.2.1.0(2,6)]decane-9-carboxylic acid methyl ester
9-ethyl-1-(ethylamino)-3,3,5,7,7-pentakis(dimethylamino)-2,4,6,8,9-pentaaza-1,3,5,7-tetraphospha(1,5--pv)bicyclo[3,3,1]nona-1,3,5,7-tetraene
5-OXO-2-(TRIFLUOROMETHYL)-5H-[1]BENZOPYRANO[2,3-b]PYRIDINE-3-CARBOXY-2',6'-XYLIDIDE
N-(2,2-dimethyl-4-oxazolidinonylmethyl)valine-pentafluorophenylthiohydantoin
1,6,10,22-Tetraazatricyclo[9.7.6.1(12,16)]pentacosa-12,14,16(25)-triene -18,23-dione, 6,10-diacetyl-15-methoxy-17-[(4-methoxyphenyl)methyl-D]-
Quercetin <3-O-methyl->, tetra-TMS
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