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GRANDIUVARIN_C;1,6-DIBENZOYLOXY-2-ACETOXYMETHYLHEX-2-(E),4-(Z)-DIENE
SpectraBase Compound ID 94xx7ShlwlT
InChI InChI=1S/C23H22O6/c1-18(24)28-16-19(17-29-23(26)21-13-6-3-7-14-21)10-8-9-15-27-22(25)20-11-4-2-5-12-20/h2-14H,15-17H2,1H3/b9-8-,19-10+
InChIKey IBWOIGRIZVKSIJ-NZOAASKNSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EfXt1YTo10Z
Name GRANDIUVARIN_C;1,6-DIBENZOYLOXY-2-ACETOXYMETHYLHEX-2-(E),4-(Z)-DIENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-18(24)28-16-19(17-29-23(26)21-13-6-3-7-14-21)10-8-9-15-27-22(25)20-11-4-2-5-12-20/h2-14H,15-17H2,1H3/b9-8-,19-10+
InChIKey IBWOIGRIZVKSIJ-NZOAASKNSA-N
Literature Reference Author S.ANKISETTY,H.N.ELSOHLY,X.C.LI,S.I.KHAN,B.L.TEKWANI,T.SMILLI E,L.WALKER
Literature Reference Citation J.NAT.PROD.,69,692(2006)
Literature Reference DOI 10.1021/np050500b
Molecular Weight 394.424 g/mol
Solvent CDCl3
Source File Reference UWMZ18314