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3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID
SpectraBase Compound ID 9rBVyQ7EZ7H
InChI InChI=1S/C48H76O19/c1-43(2)14-16-48(42(60)61)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(67-40-33(56)31(54)29(52)24(20-50)63-40)35(34(57)36(66-41)38(58)59)65-39-32(55)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-57H,9-20H2,1-7H3,(H,58,59)(H,60,61)/t22-,23+,24-,25-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-,36-,37+,39-,40+,41+,45-,46+,47+,48-/m0/s1
InChIKey YDZWHGJRWMQCDP-NEWLDQADSA-N
Mol Weight 957.1 g/mol
Molecular Formula C48H76O19
Exact Mass 956.49808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRs5UogExtV
Name 3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-[BETA-D-GALACTOPYRANOSYL-(1->3)]-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H76O19
InChI InChI=1S/C48H76O19/c1-43(2)14-16-48(42(60)61)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(67-40-33(56)31(54)29(52)24(20-50)63-40)35(34(57)36(66-41)38(58)59)65-39-32(55)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-57H,9-20H2,1-7H3,(H,58,59)(H,60,61)/t22-,23+,24-,25-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-,36-,37+,39-,40+,41+,45-,46+,47+,48-/m0/s1
InChIKey YDZWHGJRWMQCDP-NEWLDQADSA-N
Literature Reference Author A.L.TAPONDJOU,T.MIYAMOTO,M.A.LACAILLE-DUBOIS
Literature Reference Citation PHYTOCHEM.,67,2126(2006)
Literature Reference DOI 10.1016/j.phytochem.2006.06.034
Molecular Weight 957.120 g/mol
Sample ID 67128
Solvent C5D5N