SpectraBase Compound ID | KpDvQMuVCBQ |
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InChI | InChI=1S/C37H46O17/c1-46-21-9-17(10-22(47-2)29(21)40)27-20(19(13-38)7-16-8-25(50-5)32(43)34(51-6)28(16)27)15-52-37-35(33(44)31(42)26(14-39)53-37)54-36(45)18-11-23(48-3)30(41)24(12-18)49-4/h8-12,19-20,26-27,31,33,35,37-44H,7,13-15H2,1-6H3/t19-,20-,26+,27+,31+,33-,35+,37+/m1/s1 |
InChIKey | ALMDXDJFNMSYBR-UADLROQESA-N |
Mol Weight | 762.8 g/mol |
Molecular Formula | C37H46O17 |
Exact Mass | 762.2735 g/mol |
SpectraBase Spectrum ID | 9sbh0MUyAyE |
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Name | ACANFOLIOSIDE;(+)-LYONIRESINOL-3A-[2-(3,5-DIMETHOXY-4-HYDROXY)-BENZOYL]-O-BETA-GLUCOPYRANOSIDE |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C37H46O17 |
InChI | InChI=1S/C37H46O17/c1-46-21-9-17(10-22(47-2)29(21)40)27-20(19(13-38)7-16-8-25(50-5)32(43)34(51-6)28(16)27)15-52-37-35(33(44)31(42)26(14-39)53-37)54-36(45)18-11-23(48-3)30(41)24(12-18)49-4/h8-12,19-20,26-27,31,33,35,37-44H,7,13-15H2,1-6H3/t19-,20-,26+,27+,31+,33-,35+,37+/m1/s1 |
InChIKey | ALMDXDJFNMSYBR-UADLROQESA-N |
Literature Reference Author | T.KANCHANAPOOM,M.S.KAMEL,R.KASAI,K.YAMASAKI,C.PICHEANSOONTHO N,Y.HIRAGA |
Literature Reference Citation | PHYTOCHEM.,56,369(2001) |
Literature Reference DOI | 10.1016/S0031-9422(00)00362-9 |
Molecular Weight | 762.762 g/mol |
Solvent | C5D5N |
Source File Reference | UWVN1748 |