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(2S,3S,4R,5R,7S,8S,9S,11E,13S,14S)-3,5,7,8,9,14-HEXAHYDROXY-1(15->14)-ABEO-JATROPHA-6(17),11-DIEN-15-ONE-5,8-BIS-(2-METHYLBUTYRATE)-7-(2-ME

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(2S,3S,4R,5R,7S,8S,9S,11E,13S,14S)-3,5,7,8,9,14-HEXAHYDROXY-1(15->14)-ABEO-JATROPHA-6(17),11-DIEN-15-ONE-5,8-BIS-(2-METHYLBUTYRATE)-7-(2-ME
SpectraBase Compound ID AyYzBo0GFEv
InChI InChI=1S/C34H54O10/c1-12-18(5)31(39)42-25-22(9)26(43-30(38)17(3)4)27(44-32(40)19(6)13-2)29(37)33(10,11)15-14-21(8)34(41)16-20(7)24(35)23(25)28(34)36/h14-15,17-21,23-27,29,35,37,41H,9,12-13,16H2,1-8,10-11H3/b15-14+/t18?,19?,20-,21-,23+,24-,25-,26-,27+,29+,34-/m0/s1
InChIKey CTMHSHGNNQLONJ-RUROVCGZSA-N
Mol Weight 622.8 g/mol
Molecular Formula C34H54O10
Exact Mass 622.371698 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HYL5DoPjJ6M
Name (2S,3S,4R,5R,7S,8S,9S,11E,13S,14S)-3,5,7,8,9,14-HEXAHYDROXY-1(15->14)-ABEO-JATROPHA-6(17),11-DIEN-15-ONE-5,8-BIS-(2-METHYLBUTYRATE)-7-(2-ME
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H54O10
InChI InChI=1S/C34H54O10/c1-12-18(5)31(39)42-25-22(9)26(43-30(38)17(3)4)27(44-32(40)19(6)13-2)29(37)33(10,11)15-14-21(8)34(41)16-20(7)24(35)23(25)28(34)36/h14-15,17-21,23-27,29,35,37,41H,9,12-13,16H2,1-8,10-11H3/b15-14+/t18?,19?,20-,21-,23+,24-,25-,26-,27+,29+,34-/m0/s1
InChIKey CTMHSHGNNQLONJ-RUROVCGZSA-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 622.797 g/mol
Solvent CDCl3
Source File Reference UWMS867