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8-METHOXYCARBONYLOCTYL-BETA-D-GALACTOPYRANOSYL-(1->3)-2-DEOXY-2-(METHYL-BETA-D-GALACTOPYRANOSYLURONAMIDE)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID LrD8rWgNsk4
InChI InChI=1S/C29H51NO18/c1-42-15(33)9-7-5-3-4-6-8-10-44-27-16(30-26(41)25-21(38)20(37)22(39)28(43-2)48-25)24(18(35)14(12-32)45-27)47-29-23(40)19(36)17(34)13(11-31)46-29/h13-14,16-25,27-29,31-32,34-40H,3-12H2,1-2H3,(H,30,41)/t13-,14-,16-,17+,18-,19+,20-,21+,22+,23-,24-,25-,27-,28+,29+/m1/s1
InChIKey KHWKOHYYAYODGS-HSAPYZTFSA-N
Mol Weight 701.7 g/mol
Molecular Formula C29H51NO18
Exact Mass 701.310614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EO8Sp93fbux
Name 8-METHOXYCARBONYLOCTYL-BETA-D-GALACTOPYRANOSYL-(1->3)-2-DEOXY-2-(METHYL-BETA-D-GALACTOPYRANOSYLURONAMIDE)-BETA-D-GLUCOPYRANOSIDE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H51NO18
InChI InChI=1S/C29H51NO18/c1-42-15(33)9-7-5-3-4-6-8-10-44-27-16(30-26(41)25-21(38)20(37)22(39)28(43-2)48-25)24(18(35)14(12-32)45-27)47-29-23(40)19(36)17(34)13(11-31)46-29/h13-14,16-25,27-29,31-32,34-40H,3-12H2,1-2H3,(H,30,41)/t13-,14-,16-,17+,18-,19+,20-,21+,22+,23-,24-,25-,27-,28+,29+/m1/s1
InChIKey KHWKOHYYAYODGS-HSAPYZTFSA-N
Literature Reference Author G.BAISCH,R.OEHRLEIN
Literature Reference Citation CARBOHYDR.RES.,312,61(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00229-8
Molecular Weight 701.720 g/mol
Solvent DMSO-D6
Source File Reference UWPA611