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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, hydrogen sulfate, sodium salt, hydrate

Compound with spectra: 1 NMR, and 1 FTIR

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, hydrogen sulfate, sodium salt, hydrate
SpectraBase Compound ID 8Yn89OSDzrI
InChI InChI=1S/C14H18N2O9S2.2Na.H2O/c1-7(17)15-4-5-26(21)9-6-8-10(14(2,3)25-27(22,23)24)12(18)16(8)11(9)13(19)20;;;/h4-5,8,10H,6H2,1-3H3,(H,15,17)(H,19,20)(H,22,23,24);;;1H2/q;2*+1;/p-2/b5-4+;;;/t8-,10+,26?;;;/m1.../s1
InChIKey CVTFCZVRHZAXNC-MWHJYNKZSA-L
Mol Weight 484.40153856 g/mol
Molecular Formula C14H18N2Na2O10S2
Exact Mass 484.019826 g/mol
Parent InChIKey BQDQXKIGJDFKRD-ZDCWGKRSSA-L
Enantiomer InChIKey CVTFCZVRHZAXNC-ODRRNUFFSA-L

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, hydrogen sulfate, sodium salt, hydrate

1H NMR Spectrum
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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, hydrogen sulfate, sodium salt, hydrate

FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample S. Harada, Takeda Chemical Industries, Ltd., Osaka, Japan
Technique KBr WAFER
  • 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, HYDROGEN SULFATE, SODIUM SALT, HYDRATE
  • 1-AZABICYCLO/3.2.0/HEPT-2-ENE-2- CARBOXYLIC ACID, CIS-5,6-3-//TRANS-2- ACETAMIDOVINYL/SULFINYL/-6-/1-HYDROXY- 1-METHYLETHYL/-7-OXO-, MONOSODIUM SALT, HYDROGEN SULFATE, SODIUM SALT, HYDRATE
3b-Formyloxy-17b-hydroxy-pregn-5-en-20-yne
N-(4-methylbenzyl)-12-oxo-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-9-carboxamide
2-phenoxyethyl 4-(2,4-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
12-oxo-N-(2-phenylethyl)-1,2,3,4-tetrahydro-12H-[1]benzothieno[2,3-d]pyrido[1,2-a]pyrimidine-9-carboxamide
ETHYL-5-AMINO-6,7,8,9,10-PENTAHYDRO-2-METHYL-4-PHENYLCYCLOHEPTA-[B]-[1,8]-NAPHTHYRIDINE-3-CARBOXYLATE
exo-14-Methyl-3-phenylselenyl-17-oxa-1,14-diazatetracyclo[9.6.0.0(2,8).0(12,16)]heptadecan-13,15-dione
(5R/S,7R/S,E)-6-(4,5-DIHYDRO-3-TRIFLUOROACETYL-1,3-THIAZOL-2-YLIDENE)-2,3,5,7-TETRAHYDRO-5,7-DIPHENYL-[1,3]-THIAZOLO-[3,2-A]-PYRIDINE
propyl (1S,5R,7R)-3-(4-methylbenzyl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-6-carboxylate
CANNABISIN-A
9-Oxo-1-(2''-phenylethenyl)-3-(ppiperidin-1'-yl)-9H-indeno[2,1-c]pyridine-4-carbonitrile
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