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DIOSGENIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-GLUCOPYRANOSYL-(1->3)]-6-O-METHYL-BETA-D-GLUCURONOPYRANOSID
SpectraBase Compound ID 5tLrItNjCph
InChI InChI=1S/C46H72O18/c1-19-9-14-46(57-18-19)20(2)29-27(64-46)16-26-24-8-7-22-15-23(10-12-44(22,4)25(24)11-13-45(26,29)5)59-43-39(63-41-34(52)32(50)30(48)21(3)58-41)37(36(54)38(62-43)40(55)56-6)61-42-35(53)33(51)31(49)28(17-47)60-42/h7,19-21,23-39,41-43,47-54H,8-18H2,1-6H3/t19-,20-,21-,23-,24+,25-,26-,27-,28+,29-,30-,31+,32+,33-,34-,35+,36-,37-,38-,39+,41+,42-,43+,44-,45-,46+/m0/s1
InChIKey NRMNMUVROHWYER-OPUNHZLUSA-N
Mol Weight 913.1 g/mol
Molecular Formula C46H72O18
Exact Mass 912.471865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnEeKYQwRQv
Name DIOSGENIN-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[BETA-D-GLUCOPYRANOSYL-(1->3)]-6-O-METHYL-BETA-D-GLUCURONOPYRANOSID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H72O18
InChI InChI=1S/C46H72O18/c1-19-9-14-46(57-18-19)20(2)29-27(64-46)16-26-24-8-7-22-15-23(10-12-44(22,4)25(24)11-13-45(26,29)5)59-43-39(63-41-34(52)32(50)30(48)21(3)58-41)37(36(54)38(62-43)40(55)56-6)61-42-35(53)33(51)31(49)28(17-47)60-42/h7,19-21,23-39,41-43,47-54H,8-18H2,1-6H3/t19-,20-,21-,23-,24+,25-,26-,27-,28+,29-,30-,31+,32+,33-,34-,35+,36-,37-,38-,39+,41+,42-,43+,44-,45-,46+/m0/s1
InChIKey NRMNMUVROHWYER-OPUNHZLUSA-N
Literature Reference Author S.YAHARA,N.MURAKAMI,M.YAMASAKI,T.HAMADA,J.E.KINJO,T.NOHARA
Literature Reference Citation PHYTOCHEM.,24,2748(1985)
Literature Reference DOI 10.1016/S0031-9422(00)80717-7
Molecular Weight 913.067 g/mol
Solvent PYRIDINE-D5
Source File Reference UNIW17042