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COPTEROSIDE-D;3-O-BETA-[XYLOPYRANOSYL-(1->2)-GLUCURONOPYRANOSYL]-HEDERAGENIN-28-O-GLUCOPYRANOSYLESTER
SpectraBase Compound ID HGu2kXGZVQM
InChI InChI=1S/C47H74O19/c1-42(2)13-15-47(41(60)66-39-34(57)30(53)29(52)24(18-48)62-39)16-14-45(5)21(22(47)17-42)7-8-26-43(3)11-10-27(44(4,20-49)25(43)9-12-46(26,45)6)63-40-36(32(55)31(54)35(64-40)37(58)59)65-38-33(56)28(51)23(50)19-61-38/h7,22-36,38-40,48-57H,8-20H2,1-6H3,(H,58,59)/t22?,23-,24-,25?,26?,27+,28+,29-,30+,31+,32+,33-,34-,35+,36-,38+,39+,40-,43+,44+,45-,46-,47+/m1/s1
InChIKey QXSDGKCAECXLFI-UHAPKQAXSA-N
Mol Weight 943.1 g/mol
Molecular Formula C47H74O19
Exact Mass 942.48243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H25pUBTLATY
Name COPTEROSIDE-D;3-O-BETA-[XYLOPYRANOSYL-(1->2)-GLUCURONOPYRANOSYL]-HEDERAGENIN-28-O-GLUCOPYRANOSYLESTER
Compound Number 56
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H74O19
InChI InChI=1S/C47H74O19/c1-42(2)13-15-47(41(60)66-39-34(57)30(53)29(52)24(18-48)62-39)16-14-45(5)21(22(47)17-42)7-8-26-43(3)11-10-27(44(4,20-49)25(43)9-12-46(26,45)6)63-40-36(32(55)31(54)35(64-40)37(58)59)65-38-33(56)28(51)23(50)19-61-38/h7,22-36,38-40,48-57H,8-20H2,1-6H3,(H,58,59)/t22?,23-,24-,25?,26?,27+,28+,29-,30+,31+,32+,33-,34-,35+,36-,38+,39+,40-,43+,44+,45-,46-,47+/m1/s1
InChIKey QXSDGKCAECXLFI-UHAPKQAXSA-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 943.093 g/mol
Solvent C5D5N
Source File Reference UWVN1139