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28-O-[XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->4)-[XYLOPYRANOSYL-(1->3)]-RHAMNOPYRANOSYL-(1->2)-ARABINOPYRANOSYL]-OLEANOLIC-ACID-ESTER
SpectraBase Compound ID Bvp02zbr2gq
InChI InChI=1S/C56H90O23/c1-24-41(75-47-39(67)42(30(60)23-72-47)76-45-37(65)34(62)27(57)20-70-45)43(77-46-38(66)35(63)28(58)21-71-46)40(68)48(74-24)78-44-36(64)29(59)22-73-49(44)79-50(69)56-17-15-51(2,3)19-26(56)25-9-10-32-53(6)13-12-33(61)52(4,5)31(53)11-14-55(32,8)54(25,7)16-18-56/h9,24,26-49,57-68H,10-23H2,1-8H3/t24-,26?,27+,28+,29-,30+,31?,32?,33-,34-,35-,36-,37+,38+,39+,40+,41-,42-,43?,44+,45-,46-,47-,48-,49-,53-,54+,55+,56-/m0/s1
InChIKey XJRYJNHOUVZQHZ-BHACBTCUSA-N
Mol Weight 1131.3 g/mol
Molecular Formula C56H90O23
Exact Mass 1130.587289 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8oF5yKfUMK
Name 28-O-[XYLOPYRANOSYL-(1->3)-XYLOPYRANOSYL-(1->4)-[XYLOPYRANOSYL-(1->3)]-RHAMNOPYRANOSYL-(1->2)-ARABINOPYRANOSYL]-OLEANOLIC-ACID-ESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H90O23
InChI InChI=1S/C56H90O23/c1-24-41(75-47-39(67)42(30(60)23-72-47)76-45-37(65)34(62)27(57)20-70-45)43(77-46-38(66)35(63)28(58)21-71-46)40(68)48(74-24)78-44-36(64)29(59)22-73-49(44)79-50(69)56-17-15-51(2,3)19-26(56)25-9-10-32-53(6)13-12-33(61)52(4,5)31(53)11-14-55(32,8)54(25,7)16-18-56/h9,24,26-49,57-68H,10-23H2,1-8H3/t24-,26?,27+,28+,29-,30+,31?,32?,33-,34-,35-,36-,37+,38+,39+,40+,41-,42-,43?,44+,45-,46-,47-,48-,49-,53-,54+,55+,56-/m0/s1
InChIKey XJRYJNHOUVZQHZ-BHACBTCUSA-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 1131.317 g/mol
Solvent C5D5N
Source File Reference UWVN1214