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(2R*,3R*,4S*,5R*,7S*,8R*,13R*,15R*)-2,3,5,7,15-PENTAACETOXY-8-ISOBUTYROYLOXY-9,14-DIOXOJATROPHA-6(17),11E-DIENE
SpectraBase Compound ID DMpdCToNyLK
InChI InChI=1S/C34H46O14/c1-16(2)31(42)46-27-26(44-20(6)36)18(4)25(43-19(5)35)24-30(45-21(7)37)33(12,47-22(8)38)15-34(24,48-23(9)39)28(40)17(3)13-14-32(10,11)29(27)41/h13-14,16-17,24-27,30H,4,15H2,1-3,5-12H3/b14-13+/t17-,24+,25+,26+,27-,30-,33-,34-/m1/s1
InChIKey OSDVNRJELRKKGM-PNIRBJDYSA-N
Mol Weight 678.7 g/mol
Molecular Formula C34H46O14
Exact Mass 678.288756 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EyrKPrMKC2V
Name (2R*,3R*,4S*,5R*,7S*,8R*,13R*,15R*)-2,3,5,7,15-PENTAACETOXY-8-ISOBUTYROYLOXY-9,14-DIOXOJATROPHA-6(17),11E-DIENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H46O14
InChI InChI=1S/C34H46O14/c1-16(2)31(42)46-27-26(44-20(6)36)18(4)25(43-19(5)35)24-30(45-21(7)37)33(12,47-22(8)38)15-34(24,48-23(9)39)28(40)17(3)13-14-32(10,11)29(27)41/h13-14,16-17,24-27,30H,4,15H2,1-3,5-12H3/b14-13+/t17-,24+,25+,26+,27-,30-,33-,34-/m1/s1
InChIKey OSDVNRJELRKKGM-PNIRBJDYSA-N
Literature Reference Author J.JAKUPOVIC,T.MORGENSTERN,J.A.MARCO,W.BERENDSOHN
Literature Reference Citation PHYTOCHEM.,47,1611(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00832-7
Molecular Weight 678.731 g/mol
Solvent CDCl3
Source File Reference UWMS850