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(-)-(8R,8AS,12AS)-8-[1,3]DIOXOLAN-2-YL-1,4-DIHYDROXY-8A,12,12-TRIMETHYL-8,8A,9,10,11,12,12A,13-OCTAHYDRO-PENTAPHENE-5,14-DIONE

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(-)-(8R,8AS,12AS)-8-[1,3]DIOXOLAN-2-YL-1,4-DIHYDROXY-8A,12,12-TRIMETHYL-8,8A,9,10,11,12,12A,13-OCTAHYDRO-PENTAPHENE-5,14-DIONE
SpectraBase Compound ID H4gHzmVYtcK
InChI InChI=1S/C28H30O6/c1-27(2)9-4-10-28(3)19(27)13-16-14(23(28)26-33-11-12-34-26)5-6-15-20(16)25(32)22-18(30)8-7-17(29)21(22)24(15)31/h5-8,19,23,26,29-30H,4,9-13H2,1-3H3
InChIKey AFGILFLYKWANCV-UHFFFAOYSA-N
Mol Weight 462.54 g/mol
Molecular Formula C28H30O6
Exact Mass 462.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H39rbKOczdY
Name (-)-(8R,8AS,12AS)-8-[1,3]DIOXOLAN-2-YL-1,4-DIHYDROXY-8A,12,12-TRIMETHYL-8,8A,9,10,11,12,12A,13-OCTAHYDRO-PENTAPHENE-5,14-DIONE
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H30O6
InChI InChI=1S/C28H30O6/c1-27(2)9-4-10-28(3)19(27)13-16-14(23(28)26-33-11-12-34-26)5-6-15-20(16)25(32)22-18(30)8-7-17(29)21(22)24(15)31/h5-8,19,23,26,29-30H,4,9-13H2,1-3H3
InChIKey AFGILFLYKWANCV-UHFFFAOYSA-N
Literature Reference Author M.A.CUELLAR,C.SALAS,M.J.CORTES,A.MORELLO,J.D.MAYA,M.D.PREITE
Literature Reference Citation BIOORG.MED.CHEM.,11,2489(2003)
Literature Reference DOI 10.1016/s0968-0896(03)00193-7
Molecular Weight 462.543 g/mol
Solvent CDCl3
Source File Reference UWDB2012