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QWFMIWDUMBELIV-OAQYLSRUSA-N
SpectraBase Compound ID 8JzLHWdO3LT
InChI InChI=1S/C21H28O5/c1-10(2)11-14(22)12-13(16(24)18(11)26-6)21(5)9-7-8-20(3,4)19(21)17(25)15(12)23/h10,22,24-25H,7-9H2,1-6H3/t21-/m1/s1
InChIKey QWFMIWDUMBELIV-OAQYLSRUSA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BgComBF1pkv
Name COLEON-U-12-METHYLESTER;[(R)-2,3,4,4A-TETRAHYDRO-5,8,10-TRIHYDROXY-6-METHOXY-1,1,4A-TRIMETHYL-7-(1-METHYLETHYL)-9(1H)-PHENANTHRENONE]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-10(2)11-14(22)12-13(16(24)18(11)26-6)21(5)9-7-8-20(3,4)19(21)17(25)15(12)23/h10,22,24-25H,7-9H2,1-6H3/t21-/m1/s1
InChIKey QWFMIWDUMBELIV-OAQYLSRUSA-N
Literature Reference Author C.S.MATHELA,A.GUPTA,P.UPRETI,A.K.PANT,M.M.OLMSTEAD,H.HOPE,A. T.BOTTINI
Literature Reference Citation J.NAT.PROD.,54,910(1991)
Literature Reference DOI 10.1021/np50075a032
Molecular Weight 360.450 g/mol
Solvent CDCl3
Source File Reference UWCS5683