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(2S,3S)-3-Hydroxy-5,6-dimethoxy-dehydroiso-.alpha.-Lapachone
SpectraBase Compound ID 187ngZnsbn
InChI InChI=1S/C17H16O6/c1-7(2)15-14(20)11-13(19)10-8(12(18)17(11)23-15)5-6-9(21-3)16(10)22-4/h5-6,14-15,20H,1H2,2-4H3/t14-,15-/m0/s1
InChIKey QFPKXGPJZCHPEH-GJZGRUSLSA-N
Mol Weight 316.31 g/mol
Molecular Formula C17H16O6
Exact Mass 316.094688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KPs6lBfAiME
Name (2S,3S)-3-HYDROXY-5,6-DIMETHOXY-DEHYDRO-ISO-ALPHA-LAPACHONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16O6
InChI InChI=1S/C17H16O6/c1-7(2)15-14(20)11-13(19)10-8(12(18)17(11)23-15)5-6-9(21-3)16(10)22-4/h5-6,14-15,20H,1H2,2-4H3/t14-,15-/m0/s1
InChIKey QFPKXGPJZCHPEH-GJZGRUSLSA-N
Literature Reference Author C.E.HELTZEL,A.A.L.GUNATILAKA,T.E.GLASS,D.G.I.KINGSTON,G.HOFF MANN,R.K.JOHNSON
Literature Reference Citation J.NAT.PROD.,56,1500(1993)
Literature Reference DOI 10.1021/np50099a008
Molecular Weight 316.310 g/mol
Solvent CDCl3
Source File Reference UWCS17903