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PROTODIOSCIN
SpectraBase Compound ID 7WvJnQjSfaF
InChI InChI=1S/C51H84O22/c1-20(19-65-45-39(60)38(59)35(56)30(17-52)69-45)9-14-51(64)21(2)32-29(73-51)16-28-26-8-7-24-15-25(10-12-49(24,5)27(26)11-13-50(28,32)6)68-48-44(72-47-41(62)37(58)34(55)23(4)67-47)42(63)43(31(18-53)70-48)71-46-40(61)36(57)33(54)22(3)66-46/h7,20-23,25-48,52-64H,8-19H2,1-6H3/t20-,21-,22-,23-,25-,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?/m0/s1
InChIKey LVTJOONKWUXEFR-DVVNBBGCSA-N
Mol Weight 1049.2 g/mol
Molecular Formula C51H84O22
Exact Mass 1048.545424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID vFLlCLBrgl
Name PROTODIOSCIN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H84O22
InChI InChI=1S/C51H84O22/c1-20(19-65-45-39(60)38(59)35(56)30(17-52)69-45)9-14-51(64)21(2)32-29(73-51)16-28-26-8-7-24-15-25(10-12-49(24,5)27(26)11-13-50(28,32)6)68-48-44(72-47-41(62)37(58)34(55)23(4)67-47)42(63)43(31(18-53)70-48)71-46-40(61)36(57)33(54)22(3)66-46/h7,20-23,25-48,52-64H,8-19H2,1-6H3/t20-,21-,22-,23-,25-,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?/m0/s1
InChIKey LVTJOONKWUXEFR-DVVNBBGCSA-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 1049.215 g/mol
Solvent C5D5N
Source File Reference UWLU80033