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SAPONIN_3
SpectraBase Compound ID 2cvuQy2O43Z
InChI InChI=1S/C55H88O27/c1-20-7-10-55(73-17-20)21(2)34-29(82-55)12-26-24-6-5-22-11-23(8-9-53(22,3)25(24)13-33(61)54(26,34)4)74-50-42(69)39(66)44(32(16-58)77-50)78-52-47(46(38(65)31(15-57)76-52)80-49-41(68)36(63)28(60)19-72-49)81-51-43(70)45(37(64)30(14-56)75-51)79-48-40(67)35(62)27(59)18-71-48/h20-32,34-52,56-60,62-70H,5-19H2,1-4H3/t20-,21+,22+,23+,24-,25+,26+,27+,28-,29+,30+,31+,32-,34+,35-,36+,37+,38+,39-,40+,41-,42-,43+,44+,45-,46-,47+,48-,49+,50-,51-,52-,53+,54-,55-/m1/s1
InChIKey VRHRSSKYXDMEDI-JAIKYFKFSA-N
Mol Weight 1181.3 g/mol
Molecular Formula C55H88O27
Exact Mass 1180.551298 g/mol
Enantiomer InChIKey VRHRSSKYXDMEDI-NLFCNTJZSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C5D5N
Title Journal or Book Year
Steroidal saponins from the leaves of Agave macroacantha Fitoterapia 2010

This compound is available in the following databases:

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