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BUTYRAXANTHONE_B;5,8,9-TRIHYDROXY-2,2-DIMETHYL-7,10-BIS-(3-METHYLBUT-2-EN-1-YL)-2-H,6-H-PYRANO-[3.2-B]-XANTHEN-6-ONE
SpectraBase Compound ID 5qRvkuiX8K6
InChI InChI=1S/C28H30O6/c1-14(2)7-9-17-21-26(32)22-20(13-19-16(23(22)29)11-12-28(5,6)34-19)33-27(21)18(10-8-15(3)4)25(31)24(17)30/h7-8,11-13,29-31H,9-10H2,1-6H3
InChIKey RSIYYKNXUHFPPG-UHFFFAOYSA-N
Mol Weight 462.54 g/mol
Molecular Formula C28H30O6
Exact Mass 462.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LmgdlpCAsIk
Name BUTYRAXANTHONE_B;5,8,9-TRIHYDROXY-2,2-DIMETHYL-7,10-BIS-(3-METHYLBUT-2-EN-1-YL)-2-H,6-H-PYRANO-[3.2-B]-XANTHEN-6-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H30O6
InChI InChI=1S/C28H30O6/c1-14(2)7-9-17-21-26(32)22-20(13-19-16(23(22)29)11-12-28(5,6)34-19)33-27(21)18(10-8-15(3)4)25(31)24(17)30/h7-8,11-13,29-31H,9-10H2,1-6H3
InChIKey RSIYYKNXUHFPPG-UHFFFAOYSA-N
Literature Reference Author F.ZELEFACK,D.GUILET,N.FABRE,C.BAYET,S.CHEVALLEY,S.HGOUELA,B. N.LENTA,A.VALENTIN,E
Literature Reference Citation J.NAT.PROD.,72,954(2009)
Literature Reference DOI 10.1021/np8005953
Molecular Weight 462.543 g/mol
Sample ID 32626
Solvent CDCl3