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DUBIOSIDE-A
SpectraBase Compound ID 8xys88bAuu3
InChI InChI=1S/C53H84O23/c1-22-32(59)36(63)39(66)43(70-22)74-41-33(60)25(57)20-69-45(41)76-47(68)53-15-14-48(2,3)16-24(53)23-8-9-29-49(4)12-11-31(50(5,21-56)28(49)10-13-51(29,6)52(23,7)17-30(53)58)73-46-42(38(65)35(62)27(19-55)72-46)75-44-40(67)37(64)34(61)26(18-54)71-44/h8,21-22,24-46,54-55,57-67H,9-20H2,1-7H3/t22-,24-,25-,26+,27+,28?,29?,30+,31-,32-,33-,34-,35+,36+,37-,38-,39+,40+,41+,42+,43-,44-,45-,46-,49-,50-,51+,52+,53+/m0/s1
InChIKey JKDDGBWITLYMDT-SDKTYYFUSA-N
Mol Weight 1089.2 g/mol
Molecular Formula C53H84O23
Exact Mass 1088.540339 g/mol
Enantiomer InChIKey JKDDGBWITLYMDT-DWYIANBMSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent PYRIDINE-D5
Title Journal or Book Year
Saponins from Collinsonia canadensis Journal of Natural Products 1992

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