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SAPONIN_PK
SpectraBase Compound ID ILxyUW6orWn
InChI InChI=1S/C59H96O26/c1-24-34(63)38(67)42(71)49(78-24)83-46-29(20-60)80-48(45(74)41(46)70)77-22-30-37(66)40(69)44(73)51(81-30)85-53(75)59-17-15-54(3,4)19-27(59)26-9-10-32-55(5)13-12-33(56(6,23-61)31(55)11-14-58(32,8)57(26,7)16-18-59)82-52-47(36(65)28(62)21-76-52)84-50-43(72)39(68)35(64)25(2)79-50/h9,24-25,27-52,60-74H,10-23H2,1-8H3/t24-,25-,27?,28-,29+,30+,31?,32?,33-,34-,35-,36-,37+,38+,39+,40-,41+,42+,43+,44+,45+,46+,47+,48?,49?,50?,51?,52?,55-,56+,57+,58+,59?/m0/s1
InChIKey RYHDIBJJJRNDSX-WNZCWCFSSA-N
Mol Weight 1221.4 g/mol
Molecular Formula C59H96O26
Exact Mass 1220.618983 g/mol
Enantiomer InChIKey RYHDIBJJJRNDSX-WAHZNQGESA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Triterpenoid Saponins from Clematis tangutica Planta Medica 2001

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