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28-O-[GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL-(1->6)-[GALACTOPYRANOSYL-(1->4)]-GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL]-OLEANOLIC-ACID-ESTER
SpectraBase Compound ID 9Rj2118jwlV
InChI InChI=1S/C60H98O28/c1-55(2)14-16-60(17-15-58(6)24(25(60)18-55)8-9-32-57(5)12-11-33(63)56(3,4)31(57)10-13-59(32,58)7)54(78)88-53-46(76)41(71)37(67)29(85-53)22-80-51-47(77)42(72)48(87-52-45(75)39(69)35(65)27(20-62)83-52)30(86-51)23-81-50-44(74)40(70)36(66)28(84-50)21-79-49-43(73)38(68)34(64)26(19-61)82-49/h8,25-53,61-77H,9-23H2,1-7H3/t25?,26-,27+,28?,29+,30?,31?,32?,33-,34-,35-,36-,37+,38+,39-,40+,41-,42-,43-,44-,45+,46+,47-,48-,49-,50-,51-,52-,53-,57-,58+,59+,60-/m0/s1
InChIKey WVDMEVRFYNNFMP-IGWUWQMISA-N
Mol Weight 1267.4 g/mol
Molecular Formula C60H98O28
Exact Mass 1266.624462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AvCG1ewfXiZ
Name 28-O-[GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL-(1->6)-[GALACTOPYRANOSYL-(1->4)]-GLUCOPYRANOSYL-(1->6)-GLUCOPYRANOSYL]-OLEANOLIC-ACID-ESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H98O28
InChI InChI=1S/C60H98O28/c1-55(2)14-16-60(17-15-58(6)24(25(60)18-55)8-9-32-57(5)12-11-33(63)56(3,4)31(57)10-13-59(32,58)7)54(78)88-53-46(76)41(71)37(67)29(85-53)22-80-51-47(77)42(72)48(87-52-45(75)39(69)35(65)27(20-62)83-52)30(86-51)23-81-50-44(74)40(70)36(66)28(84-50)21-79-49-43(73)38(68)34(64)26(19-61)82-49/h8,25-53,61-77H,9-23H2,1-7H3/t25?,26-,27+,28?,29+,30?,31?,32?,33-,34-,35-,36-,37+,38+,39-,40+,41-,42-,43-,44-,45+,46+,47-,48-,49-,50-,51-,52-,53-,57-,58+,59+,60-/m0/s1
InChIKey WVDMEVRFYNNFMP-IGWUWQMISA-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 1267.421 g/mol
Solvent C5D5N
Source File Reference UWVN1213