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3-O-[[BETA-D-GLUCOPYRANOSYL-(1->4)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL]-OLEANIC-ACID
SpectraBase Compound ID JHZjwcojhl4
InChI InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26-,27-,28+,29-,30-,31-,32-,33+,34+,35+,36-,37+,38-,39+,40-,44-,45+,46+,47-/m0/s1
InChIKey FYSAXYBPXKLMJO-BLZUZWHSSA-N
Mol Weight 897.1 g/mol
Molecular Formula C47H76O16
Exact Mass 896.513336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7xzOO71enIq
Name 3-O-[[BETA-D-GLUCOPYRANOSYL-(1->4)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL]-OLEANIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H76O16
InChI InChI=1S/C47H76O16/c1-22-30(49)33(52)35(54)38(59-22)63-37-32(51)26(61-39-36(55)34(53)31(50)25(20-48)60-39)21-58-40(37)62-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26-,27-,28+,29-,30-,31-,32-,33+,34+,35+,36-,37+,38-,39+,40-,44-,45+,46+,47-/m0/s1
InChIKey FYSAXYBPXKLMJO-BLZUZWHSSA-N
Literature Reference Author O.A.EKABO,N.R.FARNSWORTH,T.O.HENDERSON,G.MAO,R.MUKHERJEE
Literature Reference Citation J.NAT.PROD.,59,431(1996)
Literature Reference DOI 10.1021/np960208r
Molecular Weight 897.111 g/mol
Solvent PYRIDINE-D5
Source File Reference UWVP2458