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(R)-PEUCEDANOL 7-O-beta-D-APIOFURANOSYL-(1->6)-beta-D-GLUCOPYRANOSIDE HEPTAACETATE
SpectraBase Compound ID K9lN6GRdIYE
InChI InChI=1S/C39H48O21/c1-18(40)50-16-39(60-24(7)46)17-51-37(35(39)56-23(6)45)49-15-29-32(53-20(3)42)33(54-21(4)43)34(55-22(5)44)36(59-29)58-28-14-27-25(10-11-31(47)57-27)12-26(28)13-30(38(8,9)48)52-19(2)41/h10-12,14,29-30,32-37,48H,13,15-17H2,1-9H3/t29-,30-,32-,33+,34-,35+,36-,37-,39-/m0/s1
InChIKey FROUWCYYMSZEBO-VRRQKSDXSA-N
Mol Weight 852.8 g/mol
Molecular Formula C39H48O21
Exact Mass 852.268809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5NrFuA8b8N3
Name (R)-PEUCEDANOL 7-O-beta-D-APIOFURANOSYL-(1->6)-beta-D-GLUCOPYRANOSIDE HEPTAACETATE
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Formula C39H48O21
InChI InChI=1S/C39H48O21/c1-18(40)50-16-39(60-24(7)46)17-51-37(35(39)56-23(6)45)49-15-29-32(53-20(3)42)33(54-21(4)43)34(55-22(5)44)36(59-29)58-28-14-27-25(10-11-31(47)57-27)12-26(28)13-30(38(8,9)48)52-19(2)41/h10-12,14,29-30,32-37,48H,13,15-17H2,1-9H3/t29-,30-,32-,33+,34-,35+,36-,37-,39-/m0/s1
InChIKey FROUWCYYMSZEBO-VRRQKSDXSA-N
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