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TERMICALCICOLANONE_A;5,8,12-TRIHYDROXY-2,2-DIMETHYL-7-(3-METHYLBUT-2-ENYL)-PYRANO-[3.2-B]-XANTHEN-6-(2-H)-ONE
SpectraBase Compound ID Ipw7qTCe1Xm
InChI InChI=1S/C23H22O6/c1-11(2)5-6-12-14(24)7-8-15-16(12)19(26)17-18(25)13-9-10-23(3,4)29-21(13)20(27)22(17)28-15/h5,7-10,24-25,27H,6H2,1-4H3
InChIKey LIBMYNVOSDZKIY-UHFFFAOYSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AMfuFhTSaCC
Name TERMICALCICOLANONE_A;5,8,12-TRIHYDROXY-2,2-DIMETHYL-7-(3-METHYLBUT-2-ENYL)-PYRANO-[3.2-B]-XANTHEN-6-(2-H)-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-11(2)5-6-12-14(24)7-8-15-16(12)19(26)17-18(25)13-9-10-23(3,4)29-21(13)20(27)22(17)28-15/h5,7-10,24-25,27H,6H2,1-4H3
InChIKey LIBMYNVOSDZKIY-UHFFFAOYSA-N
Literature Reference Author S.CAO,P.J.BRODIE,J.S.MILLER,R.RANDRIANAIVO,F.RATOVOSON,C.BIR KINSHAW,R.ANDRIANTSI
Literature Reference Citation J.NAT.PROD.,70,679(2007)
Literature Reference DOI 10.1021/np060627g
Molecular Weight 394.424 g/mol
Sample ID 30197
Solvent DMSO-D6