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GUAIANIN-K;3-O-[BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-
SpectraBase Compound ID ImjKSIfdeaR
InChI InChI=1S/C65H104O31/c1-24-34(69)38(73)43(78)53(86-24)94-50-41(76)35(70)25(2)87-58(50)95-51-47(91-54-44(79)39(74)36(71)29(21-66)88-54)28(68)23-85-57(51)92-48-37(72)30(22-67)89-56(46(48)81)96-59(84)65-18-16-60(3,4)20-27(65)26-10-11-32-62(7)14-13-33(90-55-45(80)40(75)42(77)49(93-55)52(82)83)61(5,6)31(62)12-15-64(32,9)63(26,8)17-19-65/h10,24-25,27-51,53-58,66-81H,11-23H2,1-9H3,(H,82,83)/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+,53+,54+,55+,56-,57+,58+,62-,63+,64+,65-/m0/s1
InChIKey WWERAVCTKMESIH-RGWQVVAUSA-N
Mol Weight 1381.5 g/mol
Molecular Formula C65H104O31
Exact Mass 1380.656157 g/mol
Enantiomer InChIKey WWERAVCTKMESIH-OHTHNWHCSA-N
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Solvent CD3OD:D2O
Title Journal or Book Year
Isolation and Structure Elucidation of Saponins from the Fruit of Guaiacum officinale Journal of Natural Products 1990
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