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TITHOFOLINOLIDE;(1R,3S,4S)-3-ACETOXY-1,4-DIHYDROXY-8-ISOBUTYLOXYEUDESM-11(13)-EN-6,12-OLIDE
SpectraBase Compound ID BB5yYuKuOX2
InChI InChI=1S/C21H30O8/c1-9(2)18(24)28-12-8-20(5)13(23)7-14(27-11(4)22)21(6,26)17(20)16-15(12)10(3)19(25)29-16/h9,12-17,23,26H,3,7-8H2,1-2,4-6H3/t12-,13-,14+,15-,16+,17-,20+,21-/m1/s1
InChIKey UABMYELNJDXARW-SYUVKRIKSA-N
Mol Weight 410.46 g/mol
Molecular Formula C21H30O8
Exact Mass 410.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E7UupZd1CZF
Name TITHOFOLINOLIDE;(1R,3S,4S)-3-ACETOXY-1,4-DIHYDROXY-8-ISOBUTYLOXYEUDESM-11(13)-EN-6,12-OLIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O8
InChI InChI=1S/C21H30O8/c1-9(2)18(24)28-12-8-20(5)13(23)7-14(27-11(4)22)21(6,26)17(20)16-15(12)10(3)19(25)29-16/h9,12-17,23,26H,3,7-8H2,1-2,4-6H3/t12-,13-,14+,15-,16+,17-,20+,21-/m1/s1
InChIKey UABMYELNJDXARW-SYUVKRIKSA-N
Literature Reference Author J.Q.GU,J.J.GILLS,E.J.PARK,E.MATA-GREENWOOD,M.E.HAWTHORNE,F.A XELROD,P.I.CHAVEZ,H.
Literature Reference Citation J.NAT.PROD.,65,532(2002)
Literature Reference DOI 10.1021/np010545m
Molecular Weight 410.464 g/mol
Solvent CDCl3
Source File Reference UWSI5600