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EXCAVATIN-E;(5'R)-7-[(2E)-4-(2,5-DIHYDRO-3-HYDROXYMETHYL-2-OXO-5-FURANYL)-3-METHYLBUT-2-ENYLOXY]-COUMARIN
SpectraBase Compound ID JgJeMQp4BRy
InChI InChI=1S/C19H18O6/c1-12(8-16-9-14(11-20)19(22)24-16)6-7-23-15-4-2-13-3-5-18(21)25-17(13)10-15/h2-6,9-10,16,20H,7-8,11H2,1H3/b12-6+/t16-/m1/s1
InChIKey NYBMIJVQEQCOLI-GXDWLZFVSA-N
Mol Weight 342.35 g/mol
Molecular Formula C19H18O6
Exact Mass 342.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lp6Da8doJJ7
Name EXCAVATIN-E;(5'R)-7-[(2E)-4-(2,5-DIHYDRO-3-HYDROXYMETHYL-2-OXO-5-FURANYL)-3-METHYLBUT-2-ENYLOXY]-COUMARIN
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18O6
InChI InChI=1S/C19H18O6/c1-12(8-16-9-14(11-20)19(22)24-16)6-7-23-15-4-2-13-3-5-18(21)25-17(13)10-15/h2-6,9-10,16,20H,7-8,11H2,1H3/b12-6+/t16-/m1/s1
InChIKey NYBMIJVQEQCOLI-GXDWLZFVSA-N
Literature Reference Author T.T.THUY,H.RIPPERGER,A.PORZEL,T.V.SUNG,G.ADAM
Literature Reference Citation PHYTOCHEM.,52,511(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00122-3
Molecular Weight 342.348 g/mol
Solvent DMSO-D6
Source File Reference UWVN637