John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4hYC5XBBNKS SpectraBase Spectrum ID=10w9UgUu4k4

(accessed ).
EUPACHINILIDE-I;8-BETA-(4ï-ACETOXYANGELYLOXY)-2-ALPHA-HYDROXY-6-BETA-H,7-ALPHA-H-GERMARCA-1(10)-E,4-E,11(13)-TRIENE-6,12-OLIDE
SpectraBase Compound ID 4hYC5XBBNKS
InChI InChI=1S/C22H28O7/c1-12-8-17(24)9-13(2)11-19-20(15(4)22(26)29-19)18(10-12)28-21(25)14(3)6-7-27-16(5)23/h6,8,11,17-20,24H,4,7,9-10H2,1-3,5H3/b12-8+,13-11+,14-6-/t17-,18-,19-,20-/m1/s1
InChIKey GHYQAZLCOXMXSD-RONZUUBFSA-N
Mol Weight 404.46 g/mol
Molecular Formula C22H28O7
Exact Mass 404.183504 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10w9UgUu4k4
Name EUPACHINILIDE-I;8-BETA-(4ï-ACETOXYANGELYLOXY)-2-ALPHA-HYDROXY-6-BETA-H,7-ALPHA-H-GERMARCA-1(10)-E,4-E,11(13)-TRIENE-6,12-OLIDE
Compound Number 9
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O7
InChI InChI=1S/C22H28O7/c1-12-8-17(24)9-13(2)11-19-20(15(4)22(26)29-19)18(10-12)28-21(25)14(3)6-7-27-16(5)23/h6,8,11,17-20,24H,4,7,9-10H2,1-3,5H3/b12-8+,13-11+,14-6-/t17-,18-,19-,20-/m1/s1
InChIKey GHYQAZLCOXMXSD-RONZUUBFSA-N
Literature Reference Author S.P.YANG,J.HUO,Y.WANG,L.G.LOU,J.M.YUE
Literature Reference Citation J.NAT.PROD.,67,638(2004)
Literature Reference DOI 10.1021/np0304159
Molecular Weight 404.460 g/mol
Solvent CDCl3
Source File Reference UWMZ7120
SpectraBase Batch ID 58uBniOMPs2