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(2R,3R,4R,5R,7S,8S,9S,11E,13S,15R)-2,3,5,7,8,9,15-HEPTAHYDROXYJATROPHA-6(17),11-DIENE-14-ONE-2,3,8,9-TETRAACETATE-5,7-BIS-(2-METHYLPROPIONAT
SpectraBase Compound ID LxzRQFmp7ZM
InChI InChI=1S/C36H52O14/c1-17(2)32(42)48-26-20(6)27(49-33(43)18(3)4)28(45-21(7)37)31(47-23(9)39)34(11,12)15-14-19(5)29(41)36(44)16-35(13,50-24(10)40)30(25(26)36)46-22(8)38/h14-15,17-19,25-28,30-31,44H,6,16H2,1-5,7-13H3/b15-14+/t19-,25-,26-,27-,28+,30+,31+,35+,36+/m0/s1
InChIKey CKKNMUJRTBASLR-RODDQMQLSA-N
Mol Weight 708.8 g/mol
Molecular Formula C36H52O14
Exact Mass 708.335706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYsElmXHvsD
Name (2R,3R,4R,5R,7S,8S,9S,11E,13S,15R)-2,3,5,7,8,9,15-HEPTAHYDROXYJATROPHA-6(17),11-DIENE-14-ONE-2,3,8,9-TETRAACETATE-5,7-BIS-(2-METHYLPROPIONAT
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H52O14
InChI InChI=1S/C36H52O14/c1-17(2)32(42)48-26-20(6)27(49-33(43)18(3)4)28(45-21(7)37)31(47-23(9)39)34(11,12)15-14-19(5)29(41)36(44)16-35(13,50-24(10)40)30(25(26)36)46-22(8)38/h14-15,17-19,25-28,30-31,44H,6,16H2,1-5,7-13H3/b15-14+/t19-,25-,26-,27-,28+,30+,31+,35+,36+/m0/s1
InChIKey CKKNMUJRTBASLR-RODDQMQLSA-N
Literature Reference Author J.A.MARCO,J.F.SANZ-CERVERA,A.YUSTE,J.JAKUPOVIC,F.JESKE
Literature Reference Citation PHYTOCHEM.,47,1621(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00833-9
Molecular Weight 708.800 g/mol
Solvent CDCl3
Source File Reference UWMS863