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(2S,3S,4R,5R,7S,8S,9S,11E,13S,14S,15R)-3,5,7,8,9,14,15-HEPTAHYDROXYJATROPHA-6(17),11-DIENE-7-(2-METHYLPROPIONATE)-5,8-BIS-(2-METHYLBUTIRATE)
SpectraBase Compound ID 7QfYDGcFWrs
InChI InChI=1S/C36H58O11/c1-13-19(5)33(41)45-27-23(9)28(46-32(40)18(3)4)29(47-34(42)20(6)14-2)30(39)35(11,12)16-15-21(7)31(44-24(10)37)36(43)17-22(8)26(38)25(27)36/h15-16,18-22,25-31,38-39,43H,9,13-14,17H2,1-8,10-12H3/b16-15+/t19?,20?,21-,22-,25+,26-,27-,28-,29+,30+,31-,36+/m0/s1
InChIKey DVKYXWXTRXIQON-PYDKBYMQSA-N
Mol Weight 666.8 g/mol
Molecular Formula C36H58O11
Exact Mass 666.397913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9U7KdDJdyel
Name (2S,3S,4R,5R,7S,8S,9S,11E,13S,14S,15R)-3,5,7,8,9,14,15-HEPTAHYDROXYJATROPHA-6(17),11-DIENE-7-(2-METHYLPROPIONATE)-5,8-BIS-(2-METHYLBUTIRATE)
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58O11
InChI InChI=1S/C36H58O11/c1-13-19(5)33(41)45-27-23(9)28(46-32(40)18(3)4)29(47-34(42)20(6)14-2)30(39)35(11,12)16-15-21(7)31(44-24(10)37)36(43)17-22(8)26(38)25(27)36/h15-16,18-22,25-31,38-39,43H,9,13-14,17H2,1-8,10-12H3/b16-15+/t19?,20?,21-,22-,25+,26-,27-,28-,29+,30+,31-,36+/m0/s1
InChIKey DVKYXWXTRXIQON-PYDKBYMQSA-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 666.850 g/mol
Solvent CDCl3
Source File Reference UWMS862