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EUPALINILIDE-A;8-BETA-(4'-HYDROXYTIGLOYLOXY)-14-CHLORO-4-BETA,10-BETA-DIHYDROXY-1-ALPHA-H,5-ALPHA-H,6-BETA-H,7-ALPHA-H-GUAI-2,11(13)-DIEN-6,12-OLID
SpectraBase Compound ID 3U6SIGvy0t1
InChI InChI=1S/C20H25ClO7/c1-10(5-7-22)17(23)27-13-8-20(26,9-21)12-4-6-19(3,25)15(12)16-14(13)11(2)18(24)28-16/h4-6,12-16,22,25-26H,2,7-9H2,1,3H3/b10-5+/t12-,13-,14-,15+,16+,19-,20+/m1/s1
InChIKey IXLMITLRFJSJRS-FSSPUKOTSA-N
Mol Weight 412.87 g/mol
Molecular Formula C20H25ClO7
Exact Mass 412.128881 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IrYG72xhf7V
Name EUPALINILIDE-A;8-BETA-(4'-HYDROXYTIGLOYLOXY)-14-CHLORO-4-BETA,10-BETA-DIHYDROXY-1-ALPHA-H,5-ALPHA-H,6-BETA-H,7-ALPHA-H-GUAI-2,11(13)-DIEN-6,12-OLID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H25ClO7
InChI InChI=1S/C20H25ClO7/c1-10(5-7-22)17(23)27-13-8-20(26,9-21)12-4-6-19(3,25)15(12)16-14(13)11(2)18(24)28-16/h4-6,12-16,22,25-26H,2,7-9H2,1,3H3/b10-5+/t12-,13-,14-,15+,16+,19-,20+/m1/s1
InChIKey IXLMITLRFJSJRS-FSSPUKOTSA-N
Literature Reference Author J.HUO,S.P.YANG,J.DING,J.M.YUE
Literature Reference Citation J.NAT.PROD.,67,1470(2004)
Literature Reference DOI 10.1021/np040023h
Molecular Weight 412.867 g/mol
Solvent CDCl3
Source File Reference UWMZ7530