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REL-(7R,8S,1'R,3'R,4'R,6'S)-DELTA-(8')-4',6'-DIHYDROXY-3,4,3'-TRIMETHOXY-8.1',7.O.6'-NEOLIGNAN
SpectraBase Compound ID Ax7eBeFcal
InChI InChI=1S/C21H30O6/c1-6-9-20-12-18(26-5)15(22)11-21(20,23)27-19(13(20)2)14-7-8-16(24-3)17(10-14)25-4/h6-8,10,13,15,18-19,22-23H,1,9,11-12H2,2-5H3/t13-,15-,18-,19-,20-,21+/m1/s1
InChIKey IRQUJSYHHRWLLC-UIROFNFVSA-N
Mol Weight 378.47 g/mol
Molecular Formula C21H30O6
Exact Mass 378.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KrmYZB77RF
Name REL-(7R,8S,1'R,3'R,4'R,6'S)-DELTA-(8')-4',6'-DIHYDROXY-3,4,3'-TRIMETHOXY-8.1',7.O.6'-NEOLIGNAN
Compound Number 1 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O6
InChI InChI=1S/C21H30O6/c1-6-9-20-12-18(26-5)15(22)11-21(20,23)27-19(13(20)2)14-7-8-16(24-3)17(10-14)25-4/h6-8,10,13,15,18-19,22-23H,1,9,11-12H2,2-5H3/t13-,15-,18-,19-,20-,21+/m1/s1
InChIKey IRQUJSYHHRWLLC-UIROFNFVSA-N
Literature Reference Author J.M.DAVID,M.YOSHIDA,O.R.GOTTLIEB
Literature Reference Citation PHYTOCHEM.,36,491(1994)
Literature Reference DOI 10.1016/S0031-9422(00)97102-4
Molecular Weight 378.466 g/mol
Solvent CDCl3
Source File Reference UWMS25269