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MILLEWANIN_D;3-[3-(3,7-DIMETHYL-2,6-OCTADIENYL)-4-HYDROXY-5-(3-METHYL-2-BUTENYL)-PHENYL]-5,7-DIHYDROXY-4H-1-BENZOPYRAN-4-ONE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

MILLEWANIN_D;3-[3-(3,7-DIMETHYL-2,6-OCTADIENYL)-4-HYDROXY-5-(3-METHYL-2-BUTENYL)-PHENYL]-5,7-DIHYDROXY-4H-1-BENZOPYRAN-4-ONE
SpectraBase Compound ID FnFuBvAlGpc
InChI InChI=1S/C30H34O5/c1-18(2)7-6-8-20(5)10-12-22-14-23(13-21(29(22)33)11-9-19(3)4)25-17-35-27-16-24(31)15-26(32)28(27)30(25)34/h7,9-10,13-17,31-33H,6,8,11-12H2,1-5H3/b20-10+
InChIKey VIPUDTLJTQPSIX-KEBDBYFISA-N
Mol Weight 474.6 g/mol
Molecular Formula C30H34O5
Exact Mass 474.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4kiD2BqHfj5
Name MILLEWANIN_D;3-[3-(3,7-DIMETHYL-2,6-OCTADIENYL)-4-HYDROXY-5-(3-METHYL-2-BUTENYL)-PHENYL]-5,7-DIHYDROXY-4H-1-BENZOPYRAN-4-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34O5
InChI InChI=1S/C30H34O5/c1-18(2)7-6-8-20(5)10-12-22-14-23(13-21(29(22)33)11-9-19(3)4)25-17-35-27-16-24(31)15-26(32)28(27)30(25)34/h7,9-10,13-17,31-33H,6,8,11-12H2,1-5H3/b20-10+
InChIKey VIPUDTLJTQPSIX-KEBDBYFISA-N
Literature Reference Author C.ITO,M.ITOIGAWA,N.KOJIMA,H.TOKUDA,T.HIRATA,H.NISHINO,H.FURU KAWA
Literature Reference Citation J.NAT.PROD.,67,1125(2004)
Literature Reference DOI 10.1021/np030554q
Molecular Weight 474.597 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ5558