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GUAIANIN-L;3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCURONOPYRANOSYL-(3->1)-ALPHA-L-ARABINOPYRANOSYL]-
SpectraBase Compound ID 9FSWLuAIQJU
InChI InChI=1S/C65H104O32/c1-24-34(68)39(73)44(78)53(89-24)87-22-29-37(71)41(75)45(79)54(91-29)88-23-30-38(72)42(76)47(81)57(92-30)97-59(85)65-17-15-60(2,3)19-26(65)25-9-10-32-62(6)13-12-33(61(4,5)31(62)11-14-64(32,8)63(25,7)16-18-65)93-58-48(82)49(94-55-43(77)35(69)27(67)21-86-55)50(51(96-58)52(83)84)95-56-46(80)40(74)36(70)28(20-66)90-56/h9,24,26-51,53-58,66-82H,10-23H2,1-8H3,(H,83,84)/t24-,26?,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 YJBDHIGLGQRWSH-PZJAKTQOSA-N
Mol Weight 1397.5 g/mol
Molecular Formula C65H104O32
Exact Mass 1396.651071 g/mol
Enantiomer InChIKey YJBDHIGLGQRWSH-KKEULWPHSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
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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