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(+/-)-NICOLAIOIDESIN-C;(1'R*,6'R*)-(2,6-DIHYDROXY-4-METHOXYPHENYL)-(3'-ISOHEXENYL-1'-PHENYLCYCLOHEX-3'-ENYL)-METHANONE
SpectraBase Compound ID IkBbhuitBc3
InChI InChI=1S/C26H30O4/c1-17(2)8-7-9-18-12-13-21(22(14-18)19-10-5-4-6-11-19)26(29)25-23(27)15-20(30-3)16-24(25)28/h4-6,8,10-12,15-16,21-22,27-28H,7,9,13-14H2,1-3H3/t21-,22+/m1/s1
InChIKey VJYZXZFPGQYBKT-YADHBBJMSA-N
Mol Weight 406.52 g/mol
Molecular Formula C26H30O4
Exact Mass 406.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ZNADukS2tO
Name (+/-)-NICOLAIOIDESIN-C;(1'R*,6'R*)-(2,6-DIHYDROXY-4-METHOXYPHENYL)-(3'-ISOHEXENYL-1'-PHENYLCYCLOHEX-3'-ENYL)-METHANONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30O4
InChI InChI=1S/C26H30O4/c1-17(2)8-7-9-18-12-13-21(22(14-18)19-10-5-4-6-11-19)26(29)25-23(27)15-20(30-3)16-24(25)28/h4-6,8,10-12,15-16,21-22,27-28H,7,9,13-14H2,1-3H3/t21-,22+/m1/s1
InChIKey VJYZXZFPGQYBKT-YADHBBJMSA-N
Literature Reference Author J.Q.GU,E.J.PARK,J.S.VIGO,J.G.GRAHAM,H.H.S.FONG,J.M.PEZZUTO,A .D.KINGHORN
Literature Reference Citation J.NAT.PROD.,65,1616(2002)
Literature Reference DOI 10.1021/np020249p
Molecular Weight 406.522 g/mol
Solvent CDCl3
Source File Reference UWSI7198