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(2R*,3R*,4S*,5R*,7S*,8R*,13R*,15R*)-2,3,5,7,15-PENTAACETOXY-8-TIGLOYLOXY-9,14-DIOXOJATROPHA-6(17),11-DIENE
SpectraBase Compound ID KWzXSv2F6Ro
InChI InChI=1S/C35H46O14/c1-13-17(2)32(43)47-28-27(45-21(6)37)19(4)26(44-20(5)36)25-31(46-22(7)38)34(12,48-23(8)39)16-35(25,49-24(9)40)29(41)18(3)14-15-33(10,11)30(28)42/h13-15,18,25-28,31H,4,16H2,1-3,5-12H3/b15-14-,17-13+/t18-,25+,26+,27+,28-,31-,34-,35-/m0/s1
InChIKey UKVKACNHLXTJKA-JWQAAZEASA-N
Mol Weight 690.7 g/mol
Molecular Formula C35H46O14
Exact Mass 690.288756 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8WVzfhTf9gL
Name (2R*,3R*,4S*,5R*,7S*,8R*,13R*,15R*)-2,3,5,7,15-PENTAACETOXY-8-TIGLOYLOXY-9,14-DIOXOJATROPHA-6(17),11-DIENE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H46O14
InChI InChI=1S/C35H46O14/c1-13-17(2)32(43)47-28-27(45-21(6)37)19(4)26(44-20(5)36)25-31(46-22(7)38)34(12,48-23(8)39)16-35(25,49-24(9)40)29(41)18(3)14-15-33(10,11)30(28)42/h13-15,18,25-28,31H,4,16H2,1-3,5-12H3/b15-14-,17-13+/t18-,25+,26+,27+,28-,31-,34-,35-/m0/s1
InChIKey UKVKACNHLXTJKA-JWQAAZEASA-N
Literature Reference Author G.APPENDINO,S.JAKUPOVIC,G.C.TRON,J.JAKUPOVIC,V.MILON,M.BALLE RO
Literature Reference Citation J.NAT.PROD.,61,749(1998)
Literature Reference DOI 10.1021/np970507w
Molecular Weight 690.742 g/mol
Solvent CDCl3
Source File Reference UWCP188