SpectraBase Compound ID | 5tLrItNjCph |
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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 |
SpectraBase Spectrum ID | KnEeKYQwRQv |
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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 |