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SULFATRICALYSINE-E;BENZYL-ALCOHOL-[7-O-(4'-O-SULFATE)-BETA-D-GLUCOPYRANOSIDE]
SpectraBase Compound ID IGce5lr4Z1I
InChI InChI=1S/C13H18O9S/c14-6-9-12(22-23(17,18)19)10(15)11(16)13(21-9)20-7-8-4-2-1-3-5-8/h1-5,9-16H,6-7H2,(H,17,18,19)/t9-,10-,11-,12-,13-/m1/s1
InChIKey WPTUWRLWLJHBCU-SYLRKERUSA-N
Mol Weight 350.34 g/mol
Molecular Formula C13H18O9S
Exact Mass 350.067153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4KrMTgpzlzF
Name SULFATRICALYSINE-E;BENZYL-ALCOHOL-[7-O-(4'-O-SULFATE)-BETA-D-GLUCOPYRANOSIDE]
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O9S
InChI InChI=1S/C13H18O9S/c14-6-9-12(22-23(17,18)19)10(15)11(16)13(21-9)20-7-8-4-2-1-3-5-8/h1-5,9-16H,6-7H2,(H,17,18,19)/t9-,10-,11-,12-,13-/m1/s1
InChIKey WPTUWRLWLJHBCU-SYLRKERUSA-N
Literature Reference Author J.SHITAMOTO,S.SUGIMOTO,K.MATSUNAMI,H.OTSUKA,T.SHINZATO,Y.TAK EDA
Literature Reference Citation CHEM.PHARM.BULL.,59,72(2011)
Literature Reference DOI 10.1248/cpb.59.72
Molecular Weight 350.341 g/mol
Sample ID 2620
Solvent CD3OD