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LAEVIGATLACTONE_D;(1-R*,2-R*,3-E,7-E,11-E)-1-ISOPROPYL-2-HYDROXY-4,8-DIMETHYL-21-OXABICYCLO-[10.2.2]-HEXADECA-3,7,11-TRIEN-20-ONE
SpectraBase Compound ID 4JQdQJ0p66a
InChI InChI=1S/C20H30O3/c1-14(2)20-12-11-17(19(22)23-20)10-6-8-15(3)7-5-9-16(4)13-18(20)21/h7,10,13-14,18,21H,5-6,8-9,11-12H2,1-4H3/b15-7+,16-13+,17-10+/t18-,20-/m1/s1
InChIKey DXNWAXUHRVOQGY-APCNEZGLSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DhmlmuMFX3C
Name LAEVIGATLACTONE_D;(1-R*,2-R*,3-E,7-E,11-E)-1-ISOPROPYL-2-HYDROXY-4,8-DIMETHYL-21-OXABICYCLO-[10.2.2]-HEXADECA-3,7,11-TRIEN-20-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-14(2)20-12-11-17(19(22)23-20)10-6-8-15(3)7-5-9-16(4)13-18(20)21/h7,10,13-14,18,21H,5-6,8-9,11-12H2,1-4H3/b15-7+,16-13+,17-10+/t18-,20-/m1/s1
InChIKey DXNWAXUHRVOQGY-APCNEZGLSA-N
Literature Reference Author G.A.ZOU,G.DING,Z.H.SU,J.S.YANG,H.W.ZHANG,C.Z.PENG,H.A.AISA,Z .M.ZOU
Literature Reference Citation J.NAT.PROD.,73,792(2010)
Literature Reference DOI 10.1021/np100044t
Molecular Weight 318.456 g/mol
Sample ID 35421
Solvent CDCl3