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HFRYRZFPOMFNNJ-AQUJVSODSA-N
SpectraBase Compound ID 6KTpLTsT8JU
InChI InChI=1S/C81H120O44/c1-22-30-54(31-28-26-24-23-25-27-29-32-57(97)98-21)118-76-73(66(112-48(15)91)60(35(2)101-76)107-43(10)86)125-81-75(69(114-50(17)93)63(109-45(12)88)56(120-81)34-100-40(7)83)124-79-72(117-53(20)96)67(61(38(5)104-79)121-77-70(115-51(18)94)64(110-46(13)89)58(36(3)102-77)105-41(8)84)122-80-74(68(113-49(16)92)62(108-44(11)87)55(119-80)33-99-39(6)82)123-78-71(116-52(19)95)65(111-47(14)90)59(37(4)103-78)106-42(9)85/h35-38,54-56,58-81H,22-34H2,1-21H3/t35-,36+,37-,38+,54-,55-,56-,58-,59-,60-,61+,62-,63-,64-,65+,66+,67-,68+,69+,70+,71-,72-,73-,74-,75-,76+,77-,78+,79+,80+,81+/m0/s1
InChIKey HFRYRZFPOMFNNJ-AQUJVSODSA-N
Mol Weight 1797.8 g/mol
Molecular Formula C81H120O44
Exact Mass 1796.715247 g/mol
Enantiomer InChIKey HFRYRZFPOMFNNJ-MCCXSYJBSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Profiling of the Resin Glycoside Content of Mexican Jalap Roots with Purgative Activity Journal of Natural Products 2006

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