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SULFATRICALYSINE-A;METHYL-SALICYLATE-[2-O-(4'-O-SULFATE)-BETA-D-GLUCOPYRANOSIDE]
SpectraBase Compound ID 4BN0P2T4ezU
InChI InChI=1S/C14H18O11S/c1-22-13(18)7-4-2-3-5-8(7)23-14-11(17)10(16)12(9(6-15)24-14)25-26(19,20)21/h2-5,9-12,14-17H,6H2,1H3,(H,19,20,21)/t9-,10-,11-,12-,14-/m1/s1
InChIKey YEIJBEBZRAWFJT-CBLPJQPBSA-N
Mol Weight 394.35 g/mol
Molecular Formula C14H18O11S
Exact Mass 394.056983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LkpWpMYiJ4d
Name SULFATRICALYSINE-A;METHYL-SALICYLATE-[2-O-(4'-O-SULFATE)-BETA-D-GLUCOPYRANOSIDE]
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18O11S
InChI InChI=1S/C14H18O11S/c1-22-13(18)7-4-2-3-5-8(7)23-14-11(17)10(16)12(9(6-15)24-14)25-26(19,20)21/h2-5,9-12,14-17H,6H2,1H3,(H,19,20,21)/t9-,10-,11-,12-,14-/m1/s1
InChIKey YEIJBEBZRAWFJT-CBLPJQPBSA-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 394.350 g/mol
Sample ID 2616
Solvent CD3OD