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BETA-DISACCHARIDE 1 (FROM SHIGELLA BOYDII)
SpectraBase Compound ID 37iEzm4Iicw
InChI InChI=1S/C21H36N2O14/c1-7(24)4-12(28)23-13(8(2)25)18-14(22-9(3)26)10(27)5-21(37-18,20(33)34)35-6-11-15(29)16(30)17(31)19(32)36-11/h7-8,10-11,13-19,24-25,27,29-32H,4-6H2,1-3H3,(H,22,26)(H,23,28)(H,33,34)/t7-,8+,10-,11+,13+,14-,15-,16-,17+,18-,19+,21+/m0/s1
InChIKey JKEOYPHAMIFIOZ-SARJCZCKSA-N
Mol Weight 540.5 g/mol
Molecular Formula C21H36N2O14
Exact Mass 540.216654 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 94Iw7rPt3WZ
Name BETA-DISACCHARIDE 1 (FROM SHIGELLA BOYDII)
Comments ##
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Formula C21H36N2O14
InChI InChI=1S/C21H36N2O14/c1-7(24)4-12(28)23-13(8(2)25)18-14(22-9(3)26)10(27)5-21(37-18,20(33)34)35-6-11-15(29)16(30)17(31)19(32)36-11/h7-8,10-11,13-19,24-25,27,29-32H,4-6H2,1-3H3,(H,22,26)(H,23,28)(H,33,34)/t7-,8+,10-,11+,13+,14-,15-,16-,17+,18-,19+,21+/m0/s1
InChIKey JKEOYPHAMIFIOZ-SARJCZCKSA-N
Instrument Name Bruker WM-250
Literature Reference V.L.L'VOV, A.S.SHASHKOV, B.A.DMITRIEV (1987) Bioorganich.Khim.(Russ. Lang.):v.13, N2, 223-233.
NMR Standard CH3OH
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O