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3-GERANYL-6-(2,6-DIMETHYLHEPTA-1,5-DIENYL)-2-HYDROXY-6-H-BENZO-[C]-CHROMENE-7,10-DIONE
SpectraBase Compound ID FHMJQi1ZNZp
InChI InChI=1S/C32H38O4/c1-20(2)9-7-11-22(5)13-14-24-18-29-25(19-28(24)35)31-26(33)15-16-27(34)32(31)30(36-29)17-23(6)12-8-10-21(3)4/h9-10,13,15-19,30,35H,7-8,11-12,14H2,1-6H3/b22-13+,23-17+
InChIKey AJKUDYCNZQABSR-FQLUOEGPSA-N
Mol Weight 486.7 g/mol
Molecular Formula C32H38O4
Exact Mass 486.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60CDomLZyOp
Name 3-GERANYL-6-(2,6-DIMETHYLHEPTA-1,5-DIENYL)-2-HYDROXY-6-H-BENZO-[C]-CHROMENE-7,10-DIONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H38O4
InChI InChI=1S/C32H38O4/c1-20(2)9-7-11-22(5)13-14-24-18-29-25(19-28(24)35)31-26(33)15-16-27(34)32(31)30(36-29)17-23(6)12-8-10-21(3)4/h9-10,13,15-19,30,35H,7-8,11-12,14H2,1-6H3/b22-13+,23-17+
InChIKey AJKUDYCNZQABSR-FQLUOEGPSA-N
Literature Reference Author I.M.KHALIL,D.BARKER,B.R.COPP
Literature Reference Citation J.NAT.PROD.,75,2256(2012)
Literature Reference DOI 10.1021/np300790g
Molecular Weight 486.651 g/mol
Sample ID 42120
Solvent CDCl3