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(2,3-TRANS,7'',8''-ERYTHRO)-5A,5B-DIHYDROBUDDLENOL-B-PENTAACETATE
SpectraBase Compound ID 1259LgdiEJ0
InChI InChI=1S/C41H48O16/c1-22(42)51-14-10-11-27-15-30-31(20-52-23(2)43)38(57-40(30)34(16-27)48-7)29-18-35(49-8)41(36(19-29)50-9)56-37(21-53-24(3)44)39(55-26(5)46)28-12-13-32(54-25(4)45)33(17-28)47-6/h12-13,15-19,31,37-39H,10-11,14,20-21H2,1-9H3/t31-,37?,38+,39?/m1/s1
InChIKey ZCYXXYNHMIDWCN-YZEDBWDYSA-N
Mol Weight 796.8 g/mol
Molecular Formula C41H48O16
Exact Mass 796.294235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3pCJgrj3fve
Name (2,3-TRANS,7'',8''-ERYTHRO)-5A,5B-DIHYDROBUDDLENOL-B-PENTAACETATE
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H48O16
InChI InChI=1S/C41H48O16/c1-22(42)51-14-10-11-27-15-30-31(20-52-23(2)43)38(57-40(30)34(16-27)48-7)29-18-35(49-8)41(36(19-29)50-9)56-37(21-53-24(3)44)39(55-26(5)46)28-12-13-32(54-25(4)45)33(17-28)47-6/h12-13,15-19,31,37-39H,10-11,14,20-21H2,1-9H3/t31-,37?,38+,39?/m1/s1
InChIKey ZCYXXYNHMIDWCN-YZEDBWDYSA-N
Literature Reference Author K.YOSHINARI,N.SHIMAZAKI,Y.SASHIDA,Y.MIMAKI
Literature Reference Citation PHYTOCHEM.,29,1675(1990)
Literature Reference DOI 10.1016/0031-9422(90)80144-6
Molecular Weight 796.823 g/mol
Solvent CDCl3
Source File Reference UWLU32116