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SULFATRICALYSINE-C;(Z)-HEX-3-EN-1-OL-[1-O-(4'-O-SULFATE)-BETA-D-GLUCOPYRANOSIDE]
SpectraBase Compound ID 9E9vydFGGfy
InChI InChI=1S/C12H22O9S/c1-2-3-4-5-6-19-12-10(15)9(14)11(8(7-13)20-12)21-22(16,17)18/h3-4,8-15H,2,5-7H2,1H3,(H,16,17,18)/b4-3-/t8-,9-,10-,11-,12-/m1/s1
InChIKey ZXGJRJBCNZJULM-ABOVWVEUSA-N
Mol Weight 342.36 g/mol
Molecular Formula C12H22O9S
Exact Mass 342.098453 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HaLYcyC9HQG
Name SULFATRICALYSINE-C;(Z)-HEX-3-EN-1-OL-[1-O-(4'-O-SULFATE)-BETA-D-GLUCOPYRANOSIDE]
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H22O9S
InChI InChI=1S/C12H22O9S/c1-2-3-4-5-6-19-12-10(15)9(14)11(8(7-13)20-12)21-22(16,17)18/h3-4,8-15H,2,5-7H2,1H3,(H,16,17,18)/b4-3-/t8-,9-,10-,11-,12-/m1/s1
InChIKey ZXGJRJBCNZJULM-ABOVWVEUSA-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 342.361 g/mol
Sample ID 2618
Solvent CD3OD