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N-4-(AMINOSULFONYL)-PHENETHYL-S-(1-THIO-BETA-D-GALACTOPYRANOSYL)-SULFONAMIDE
SpectraBase Compound ID DcYywirhJOH
InChI InChI=1S/C14H22N2O9S2/c15-26(21,22)9-3-1-8(2-4-9)5-6-16-27(23,24)14-13(20)12(19)11(18)10(7-17)25-14/h1-4,10-14,16-20H,5-7H2,(H2,15,21,22)/t10-,11+,12+,13-,14+/m0/s1
InChIKey ZXAONDRXXSHKIC-MQLXINIDSA-N
Mol Weight 426.46 g/mol
Molecular Formula C14H22N2O9S2
Exact Mass 426.076673 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxRg77eS6Hn
Name N-4-(AMINOSULFONYL)-PHENETHYL-S-(1-THIO-BETA-D-GALACTOPYRANOSYL)-SULFONAMIDE
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22N2O9S2
InChI InChI=1S/C14H22N2O9S2/c15-26(21,22)9-3-1-8(2-4-9)5-6-16-27(23,24)14-13(20)12(19)11(18)10(7-17)25-14/h1-4,10-14,16-20H,5-7H2,(H2,15,21,22)/t10-,11+,12+,13-,14+/m0/s1
InChIKey ZXAONDRXXSHKIC-MQLXINIDSA-N
Literature Reference Author M.LOPEZ,L.F.BORNAGHI,A.INNOCENTI,D.VULLO,S.A.CHARMAN,C.T.SUP URAN,S.A.POULSEN
Literature Reference Citation J.MED.CHEM.,53,2913(2010)
Literature Reference DOI 10.1021/jm901888x
Molecular Weight 426.457 g/mol
Solvent DMSO-D6
Source File Reference UWMZ46608