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MILLEWANIN_E;5-HYDROXY-10-(2-HYDROPEROXY-3-METHYL-3-BUTENYL)-7-(4-HYDROXYPHENYL)-2,2-DIMETHYL-2H,6H-BENZO-[1,2-B:5,4-Bï]-DIPYRAN-6-ONE

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MILLEWANIN_E;5-HYDROXY-10-(2-HYDROPEROXY-3-METHYL-3-BUTENYL)-7-(4-HYDROXYPHENYL)-2,2-DIMETHYL-2H,6H-BENZO-[1,2-B:5,4-Bï]-DIPYRAN-6-ONE
SpectraBase Compound ID 5MMPfdD8VlN
InChI InChI=1S/C25H24O7/c1-13(2)19(32-29)11-17-23-16(9-10-25(3,4)31-23)21(27)20-22(28)18(12-30-24(17)20)14-5-7-15(26)8-6-14/h5-10,12,19,26-27,29H,1,11H2,2-4H3
InChIKey CKNDFQDIEXGCEU-UHFFFAOYSA-N
Mol Weight 436.46 g/mol
Molecular Formula C25H24O7
Exact Mass 436.152203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4f3J3Z9n5Wh
Name MILLEWANIN_E;5-HYDROXY-10-(2-HYDROPEROXY-3-METHYL-3-BUTENYL)-7-(4-HYDROXYPHENYL)-2,2-DIMETHYL-2H,6H-BENZO-[1,2-B:5,4-Bï]-DIPYRAN-6-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24O7
InChI InChI=1S/C25H24O7/c1-13(2)19(32-29)11-17-23-16(9-10-25(3,4)31-23)21(27)20-22(28)18(12-30-24(17)20)14-5-7-15(26)8-6-14/h5-10,12,19,26-27,29H,1,11H2,2-4H3
InChIKey CKNDFQDIEXGCEU-UHFFFAOYSA-N
Literature Reference Author C.ITO,M.ITOIGAWA,N.KOJIMA,H.TOKUDA,T.HIRATA,H.NISHINO,H.FURU KAWA
Literature Reference Citation J.NAT.PROD.,67,1125(2004)
Literature Reference DOI 10.1021/np030554q
Molecular Weight 436.461 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ5559