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5,7-DIHYDROXY-2-HEPTACOSANYLBENZOPYRAN-4-ONE

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5,7-DIHYDROXY-2-HEPTACOSANYLBENZOPYRAN-4-ONE
SpectraBase Compound ID 5KrJYwFM6Tj
InChI InChI=1S/C36H60O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-32-30-34(39)36-33(38)28-31(37)29-35(36)40-32/h28-30,37-38H,2-27H2,1H3
InChIKey QSFMDDWYUYAUEL-UHFFFAOYSA-N
Mol Weight 556.9 g/mol
Molecular Formula C36H60O4
Exact Mass 556.44916 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVUxYXPLFTE
Name 5,7-DIHYDROXY-2-(N-HEPTAEICOSANYL)-CHROMONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H60O4
InChI InChI=1S/C36H60O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-32-30-34(39)36-33(38)28-31(37)29-35(36)40-32/h28-30,37-38H,2-27H2,1H3
InChIKey QSFMDDWYUYAUEL-UHFFFAOYSA-N
Literature Reference Author M.R.D.ANDRADE,E.X.ALMEIDA,L.M.CONSERVA
Literature Reference Citation PHYTOCHEM.,47,1431(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00746-2
Molecular Weight 556.870 g/mol
Solvent CDCl3:CD3OD
Source File Reference UWMS790