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TRIJUGIN_B;9,10-EPOXY-5-BETA-O-TIGLOYL-6-ALPHA,8-BETA-DI-O-ACETYL-7-ALPHA-H-GERMACRA-3-(4)-E-ENE
SpectraBase Compound ID CWEm61zBMsK
InChI InChI=1S/C24H36O7/c1-9-14(4)23(27)30-19-15(5)11-10-12-24(8)22(31-24)21(29-17(7)26)18(13(2)3)20(19)28-16(6)25/h9,11,13,18-22H,10,12H2,1-8H3/b14-9+,15-11+/t18-,19-,20-,21-,22+,24+/m0/s1
InChIKey VAHXUPCHSREXPT-WFOSWCMWSA-N
Mol Weight 436.5 g/mol
Molecular Formula C24H36O7
Exact Mass 436.246103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lm3goVEBee9
Name TRIJUGIN_B;9,10-EPOXY-5-BETA-O-TIGLOYL-6-ALPHA,8-BETA-DI-O-ACETYL-7-ALPHA-H-GERMACRA-3-(4)-E-ENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H36O7
InChI InChI=1S/C24H36O7/c1-9-14(4)23(27)30-19-15(5)11-10-12-24(8)22(31-24)21(29-17(7)26)18(13(2)3)20(19)28-16(6)25/h9,11,13,18-22H,10,12H2,1-8H3/b14-9+,15-11+/t18-,19-,20-,21-,22+,24+/m0/s1
InChIKey VAHXUPCHSREXPT-WFOSWCMWSA-N
Literature Reference Author Z.H.PAN,Y.Y.WANG,M.M.LI,G.XU,L.Y.PENG,J.HE,Y.ZHAO,Y.LI,Q.S.Z HAO
Literature Reference Citation J.NAT.PROD.,73,1146(2010)
Literature Reference DOI 10.1021/np100250w
Molecular Weight 436.546 g/mol
Sample ID 35722
Solvent CDCl3