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3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->4)]-GLUCURONOPYRANOSYL]-GYPSOGENIN
SpectraBase Compound ID GkiGlm02mlp
InChI InChI=1S/C48H74O20/c1-43(2)13-15-48(42(61)62)16-14-46(5)21(22(48)17-43)7-8-26-44(3)11-10-27(45(4,20-51)25(44)9-12-47(26,46)6)65-41-34(58)35(66-39-32(56)30(54)28(52)23(18-49)63-39)36(37(68-41)38(59)60)67-40-33(57)31(55)29(53)24(19-50)64-40/h7,20,22-37,39-41,49-50,52-58H,8-19H2,1-6H3,(H,59,60)(H,61,62)/t22?,23-,24+,25?,26?,27-,28-,29+,30+,31-,32-,33+,34+,35+,36-,37-,39+,40-,41+,44-,45-,46+,47+,48-/m0/s1
InChIKey NQOJSPSCAGTJAO-PTAGCIHHSA-N
Mol Weight 971.1 g/mol
Molecular Formula C48H74O20
Exact Mass 970.477345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6orkXzUFF09
Name 3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[GLUCOPYRANOSYL-(1->4)]-GLUCURONOPYRANOSYL]-GYPSOGENIN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H74O20
InChI InChI=1S/C48H74O20/c1-43(2)13-15-48(42(61)62)16-14-46(5)21(22(48)17-43)7-8-26-44(3)11-10-27(45(4,20-51)25(44)9-12-47(26,46)6)65-41-34(58)35(66-39-32(56)30(54)28(52)23(18-49)63-39)36(37(68-41)38(59)60)67-40-33(57)31(55)29(53)24(19-50)64-40/h7,20,22-37,39-41,49-50,52-58H,8-19H2,1-6H3,(H,59,60)(H,61,62)/t22?,23-,24+,25?,26?,27-,28-,29+,30+,31-,32-,33+,34+,35+,36-,37-,39+,40-,41+,44-,45-,46+,47+,48-/m0/s1
InChIKey NQOJSPSCAGTJAO-PTAGCIHHSA-N
Literature Reference Author N.TAN,J.ZHOU,S.ZHAO
Literature Reference Citation PHYTOCHEM.,52,153(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00454-3
Molecular Weight 971.104 g/mol
Solvent Unknown
Source File Reference UWVN1092