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SHIKONIN-ISOVALERATE;5,8-DIHYDROXY-2-(11-ISOVALERYLOXY-14-METHYL-13-PENTENYL)-1,4-NAPHTHOQUINONE
SpectraBase Compound ID 8ZW93GImTUD
InChI InChI=1S/C21H24O6/c1-11(2)5-8-17(27-18(25)9-12(3)4)13-10-16(24)19-14(22)6-7-15(23)20(19)21(13)26/h5-7,10,12,17,22-23H,8-9H2,1-4H3/t17-/m0/s1
InChIKey UTOUNDHZJFIVPK-KRWDZBQOSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HOxO6Jwzhq
Name SHIKONIN-ISOVALERATE;5,8-DIHYDROXY-2-(11-ISOVALERYLOXY-14-METHYL-13-PENTENYL)-1,4-NAPHTHOQUINONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-11(2)5-8-17(27-18(25)9-12(3)4)13-10-16(24)19-14(22)6-7-15(23)20(19)21(13)26/h5-7,10,12,17,22-23H,8-9H2,1-4H3/t17-/m0/s1
InChIKey UTOUNDHZJFIVPK-KRWDZBQOSA-N
Literature Reference Author M.AFZAL,G.AL-ORIQAT
Literature Reference Citation AGR.BIOL.CHEM.,50,759(1986)
Literature Reference DOI 10.1271/bbb1961.50.759
Molecular Weight 372.418 g/mol
Solvent CDCl3
Source File Reference UWIR8133