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XANTHOKEISMIN_C;1-[2,3-TRANS-3,4-DIHYDROXY-2-(1,5-DIHYDROXY-1,5-DIMETHYLHEX-3-ENYL)-2,3-DIHYDROBENZOFURAN-5-YL]-3-(4-HYDROXYPHENYL)-E-PROPENONE

View entire compound with spectra: 1 NMR

XANTHOKEISMIN_C;1-[2,3-TRANS-3,4-DIHYDROXY-2-(1,5-DIHYDROXY-1,5-DIMETHYLHEX-3-ENYL)-2,3-DIHYDROBENZOFURAN-5-YL]-3-(4-HYDROXYPHENYL)-E-PROPENONE
SpectraBase Compound ID 1pYKMQCbeWb
InChI InChI=1S/C25H28O7/c1-14(2)18(27)12-13-25(3,31)24-23(30)21-20(32-24)11-9-17(22(21)29)19(28)10-6-15-4-7-16(26)8-5-15/h4-11,18,23-24,26-27,29-31H,1,12-13H2,2-3H3/b10-6+/t18?,23-,24-,25?/m0/s1
InChIKey QVZYQQARMOXBPW-IRTNKAGMSA-N
Mol Weight 440.49 g/mol
Molecular Formula C25H28O7
Exact Mass 440.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E6q6Fm6BX6d
Name XANTHOKEISMIN_C;1-[2,3-TRANS-3,4-DIHYDROXY-2-(1,5-DIHYDROXY-1,5-DIMETHYLHEX-3-ENYL)-2,3-DIHYDROBENZOFURAN-5-YL]-3-(4-HYDROXYPHENYL)-E-PROPENONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O7
InChI InChI=1S/C25H28O7/c1-14(2)18(27)12-13-25(3,31)24-23(30)21-20(32-24)11-9-17(22(21)29)19(28)10-6-15-4-7-16(26)8-5-15/h4-11,18,23-24,26-27,29-31H,1,12-13H2,2-3H3/b10-6+/t18?,23-,24-,25?/m0/s1
InChIKey QVZYQQARMOXBPW-IRTNKAGMSA-N
Literature Reference Author N.AOKI,M.MUKO,E.OHTA,S.OHTA
Literature Reference Citation J.NAT.PROD.,71,1308(2008)
Literature Reference DOI 10.1021/np800187f
Molecular Weight 440.493 g/mol
Sample ID 28770
Solvent CDCl3:CD3OD=9:1