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11-((E)-3,7-Dimethyl-octa-2,6-dienyl)-2-(3-methyl-but-2-enyl)-dibenzo[b,f]oxepine-3,7,10-triol
SpectraBase Compound ID 9oYLnS8fKJO
InChI InChI=1S/C29H34O4/c1-18(2)7-6-8-20(5)10-13-23-25-15-21(11-9-19(3)4)26(31)17-28(25)33-27-16-22(30)12-14-24(27)29(23)32/h7,9-10,12,14-17,30-32H,6,8,11,13H2,1-5H3/b20-10+
InChIKey JOOCFKONPKMQIN-KEBDBYFISA-N
Mol Weight 446.6 g/mol
Molecular Formula C29H34O4
Exact Mass 446.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xEd0tT42NT
Name 11-((E)-3,7-Dimethyl-octa-2,6-dienyl)-2-(3-methyl-but-2-enyl)-dibenzo[b,f]oxepine-3,7,10-triol
Alternate Name(s) 11-[(2E)-3,7-dimethyl-2,6-octadienyl]-2-(3-methyl-2-butenyl)dibenzo[b,f]oxepin-3,7,10-triol 2-[3',7'-Dimethylocta-2',6'-dienyl)-3-(3''-methylbut-2''-enyl)dibenzo[b,f]pyrano[2,3-d]oxepin-3,7,10-triol Artocarpol E
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Formula C29H34O4
InChI InChI=1S/C29H34O4/c1-18(2)7-6-8-20(5)10-13-23-25-15-21(11-9-19(3)4)26(31)17-28(25)33-27-16-22(30)12-14-24(27)29(23)32/h7,9-10,12,14-17,30-32H,6,8,11,13H2,1-5H3/b20-10+
InChIKey JOOCFKONPKMQIN-KEBDBYFISA-N
Molecular Weight 446.587 g/mol
SMILES Oc1ccc2c(Oc3c(C(=C2O)C\C=C\(CCC=C(C)C)C)cc(c(c3)O)CC=C(C)C)c1
SPLASH splash10-01b9-9488500000-9a423bf6c265ab647a20
Source of Spectrum H-83-3005-4
Wiley ID 847302