John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=If3kY5ZDAGm

(accessed ).
PEDUNCULOSIMOSIDE_C;5'-(3-METHYL-2-BUTEN-1-YL)-OPHIOGLONOL_7-O-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID If3kY5ZDAGm
InChI InChI=1S/C33H40O17/c1-12(2)3-4-13-5-14(6-18(38)23(13)39)30-16(9-34)24(40)22-17(37)7-15(8-19(22)47-30)46-33-31(28(44)26(42)21(11-36)49-33)50-32-29(45)27(43)25(41)20(10-35)48-32/h3,5-8,20-21,25-29,31-39,41-45H,4,9-11H2,1-2H3/t20-,21-,25-,26-,27+,28+,29-,31-,32+,33-/m1/s1
InChIKey ZDGISMQFYIDRSP-KZGGGLRYSA-N
Mol Weight 708.7 g/mol
Molecular Formula C33H40O17
Exact Mass 708.22655 g/mol
Enantiomer InChIKey ZDGISMQFYIDRSP-WPLJQJFASA-N
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