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3-O-[BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-OLEANOIC-ACID
SpectraBase Compound ID 75Vx99RmwG2
InChI InChI=1S/C41H66O11/c1-21-32(52-33-30(45)28(43)24(42)20-49-33)29(44)31(46)34(50-21)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27-,28+,29-,30-,31+,32-,33+,34+,38-,39+,40+,41-/m0/s1
InChIKey JULKFTDQYVYPAN-GBIWKRIHSA-N
Mol Weight 735.0 g/mol
Molecular Formula C41H66O11
Exact Mass 734.460513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID jrCz8ImkKH
Name 3-O-[BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-OLEANOIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H66O11
InChI InChI=1S/C41H66O11/c1-21-32(52-33-30(45)28(43)24(42)20-49-33)29(44)31(46)34(50-21)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27-,28+,29-,30-,31+,32-,33+,34+,38-,39+,40+,41-/m0/s1
InChIKey JULKFTDQYVYPAN-GBIWKRIHSA-N
Literature Reference Author E.P.KEMERTELIDZE,L.N.GVAZAVA,M.D.ALANIA,V.S.KIKOLADZE,V.G.TS ITSISHVILI
Literature Reference Citation J.NAT.PROD.,55,217(1992)
Literature Reference DOI 10.1021/np50080a010
Molecular Weight 734.968 g/mol
Solvent C5D5N
Source File Reference UWCS15321