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#2;15-METHOXY-PSEUDOPROTODIOSCIN;(25R)-26-O-BETA-D-GLUCOPYRANOSYL-5,20-DIENE-15-METHOXY-3-BETA,26-DIHYDROXY-FUROST-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-
SpectraBase Compound ID 4BF8ikKSyON
InChI InChI=1S/C52H84O22/c1-20(19-66-47-39(61)38(60)35(57)29(17-53)71-47)8-11-28-21(2)31-45(70-28)44(65-7)32-26-10-9-24-16-25(12-14-51(24,5)27(26)13-15-52(31,32)6)69-50-46(74-49-41(63)37(59)34(56)23(4)68-49)42(64)43(30(18-54)72-50)73-48-40(62)36(58)33(55)22(3)67-48/h9,20,22-23,25-27,29-50,53-64H,8,10-19H2,1-7H3/t20-,22-,23-,25-,26+,27-,29+,30+,31-,32+,33-,34-,35+,36+,37+,38-,39+,40+,41+,42-,43+,44?,45+,46+,47+,48-,49-,50+,51-,52+/m0/s1
InChIKey FEIHPQZUCHSYKB-NIWMGAPNSA-N
Mol Weight 1061.2 g/mol
Molecular Formula C52H84O22
Exact Mass 1060.545424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LQ37TiVVVgu
Name #2;15-METHOXY-PSEUDOPROTODIOSCIN;(25R)-26-O-BETA-D-GLUCOPYRANOSYL-5,20-DIENE-15-METHOXY-3-BETA,26-DIHYDROXY-FUROST-3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H84O22
InChI InChI=1S/C52H84O22/c1-20(19-66-47-39(61)38(60)35(57)29(17-53)71-47)8-11-28-21(2)31-45(70-28)44(65-7)32-26-10-9-24-16-25(12-14-51(24,5)27(26)13-15-52(31,32)6)69-50-46(74-49-41(63)37(59)34(56)23(4)68-49)42(64)43(30(18-54)72-50)73-48-40(62)36(58)33(55)22(3)67-48/h9,20,22-23,25-27,29-50,53-64H,8,10-19H2,1-7H3/t20-,22-,23-,25-,26+,27-,29+,30+,31-,32+,33-,34-,35+,36+,37+,38-,39+,40+,41+,42-,43+,44?,45+,46+,47+,48-,49-,50+,51-,52+/m0/s1
InChIKey FEIHPQZUCHSYKB-NIWMGAPNSA-N
Literature Reference Author H.L.HUANG,T.H.LIU,F.SHAO
Literature Reference Citation MAGN.RES.CHEM.,47,741(2009)
Literature Reference DOI 10.1002/mrc.2455
Molecular Weight 1061.226 g/mol
Solvent C5D5N
Source File Reference UWLU80029