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(2'E,7'Z,1''-ALPHA,4A''-BETA,8A''-ALPHA)-2-[3',7'-DIMETHYL-9'-(2'',5'',5'',8A''-TETRAMETHYL-1'',4'',4A'',5'',6'',7'',8'',8A''-OCTAHYDRONAPHTHALEN-1''-YL)-
SpectraBase Compound ID 1LPxrsB2m1d
InChI InChI=1S/C31H46O2/c1-22(11-14-25-21-26(32)15-17-28(25)33)9-7-10-23(2)12-16-27-24(3)13-18-29-30(4,5)19-8-20-31(27,29)6/h11-13,15,17,21,27,29,32-33H,7-10,14,16,18-20H2,1-6H3/b22-11+,23-12-/t27-,29-,31+/m0/s1
InChIKey FBBXOWQBMFRXRO-MEVHTVKHSA-N
Mol Weight 450.7 g/mol
Molecular Formula C31H46O2
Exact Mass 450.349781 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8s9pLG46Hwj
Name COSCINOQUINOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46O2
InChI InChI=1S/C31H46O2/c1-22(11-14-25-21-26(32)15-17-28(25)33)9-7-10-23(2)12-16-27-24(3)13-18-29-30(4,5)19-8-20-31(27,29)6/h11-13,15,17,21,27,29,32-33H,7-10,14,16,18-20H2,1-6H3/b22-11+,23-12-/t27-,29-,31+/m0/s1
InChIKey FBBXOWQBMFRXRO-MEVHTVKHSA-N
Literature Reference Author M.MUSMAN,I.I.OHTANI,D.NAGAOKA,J.TANAKA,T.HIGA
Literature Reference Citation J.NAT.PROD.,64,350(2001)
Literature Reference DOI 10.1021/np000060i
Molecular Weight 450.705 g/mol
Solvent CD3OD
Source File Reference UWRU3835