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3-BETA,12-(S)-DIHYDROXYCLERODA-4-(18),13-DIEN-15,16-OLIDE
SpectraBase Compound ID 6fEFaivsUHT
InChI InChI=1S/C20H30O4/c1-12-7-8-19(3)13(2)15(21)5-6-17(19)20(12,4)10-16(22)14-9-18(23)24-11-14/h9,12,15-17,21-22H,2,5-8,10-11H2,1,3-4H3/t12-,15+,16-,17+,19+,20+/m1/s1
InChIKey LOVGAILAPVOSFV-NHJWICSWSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I33zVGIjLi0
Name 3-BETA,12-(S)-DIHYDROXYCLERODA-4-(18),13-DIEN-15,16-OLIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-12-7-8-19(3)13(2)15(21)5-6-17(19)20(12,4)10-16(22)14-9-18(23)24-11-14/h9,12,15-17,21-22H,2,5-8,10-11H2,1,3-4H3/t12-,15+,16-,17+,19+,20+/m1/s1
InChIKey LOVGAILAPVOSFV-NHJWICSWSA-N
Literature Reference Author W.P.JONES,T.LOBO-ECHEVERRI,Q.MI,H.B.CHAI,D.D.SOEJARTO,G.A.CO RDELL,S.M.SWANSON,A.
Literature Reference Citation J.NAT.PROD.,70,372(2007)
Literature Reference DOI 10.1021/np060534z
Molecular Weight 334.456 g/mol
Sample ID 30414
Solvent CDCl3