For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

CLARKINOL;REL-(7R,8R,1'S,3'R,4'S)-DELTA-(8')-1',2',3',4'-TETRAHYDRO-4'-HYDROXY-5'-METHOXY-3,4-METHYLENEDIOXY-2'-OXO-7.3',8.1'-LIGNAN

View entire compound with spectra: 1 NMR

CLARKINOL;REL-(7R,8R,1'S,3'R,4'S)-DELTA-(8')-1',2',3',4'-TETRAHYDRO-4'-HYDROXY-5'-METHOXY-3,4-METHYLENEDIOXY-2'-OXO-7.3',8.1'-LIGNAN
SpectraBase Compound ID KKHU0A1yKUb
InChI InChI=1S/C20H22O5/c1-4-7-20-9-15(23-3)18(21)17(19(20)22)16(11(20)2)12-5-6-13-14(8-12)25-10-24-13/h4-6,8-9,11,16-18,21H,1,7,10H2,2-3H3/t11-,16+,17-,18-,20-/m1/s1
InChIKey LMEBFVJZZLWXDR-XXOPDAEVSA-N
Mol Weight 342.39 g/mol
Molecular Formula C20H22O5
Exact Mass 342.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID J0dSZzM9bvw
Name CLARKINOL;REL-(7R,8R,1'S,3'R,4'S)-DELTA-(8')-1',2',3',4'-TETRAHYDRO-4'-HYDROXY-5'-METHOXY-3,4-METHYLENEDIOXY-2'-OXO-7.3',8.1'-LIGNAN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22O5
InChI InChI=1S/C20H22O5/c1-4-7-20-9-15(23-3)18(21)17(19(20)22)16(11(20)2)12-5-6-13-14(8-12)25-10-24-13/h4-6,8-9,11,16-18,21H,1,7,10H2,2-3H3/t11-,16+,17-,18-,20-/m1/s1
InChIKey LMEBFVJZZLWXDR-XXOPDAEVSA-N
Literature Reference Author S.JENSEN,C.E.OLSEN,O.D.TYAGI,P.M.BOLL,F.A.HUSSAINI,S.GUPTA,K .S.BISHT,V.S.PARMAR
Literature Reference Citation PHYTOCHEM.,36,789(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89819-2
Molecular Weight 342.392 g/mol
Solvent CDCl3
Source File Reference UWMS25744