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GEMICHALCONE-B;3'-[GAMMA-HYDROXYMETHYL-(Z)-GAMMA-METHYLALLYL]-2',4',4-TRIHYDROXYCHALCONE-11'-O-COUMARATE
SpectraBase Compound ID AcqAPzkas1h
InChI InChI=1S/C29H26O7/c1-19(18-36-28(34)17-8-21-5-11-23(31)12-6-21)2-13-24-27(33)16-14-25(29(24)35)26(32)15-7-20-3-9-22(30)10-4-20/h2-12,14-17,30-31,33,35H,13,18H2,1H3/b15-7+,17-8+,19-2-
InChIKey YKTQNXNBVRMYNF-VFZUQKNSSA-N
Mol Weight 486.52 g/mol
Molecular Formula C29H26O7
Exact Mass 486.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 64C3JgK31jx
Name GEMICHALCONE-B;3'-[GAMMA-HYDROXYMETHYL-(Z)-GAMMA-METHYLALLYL]-2',4',4-TRIHYDROXYCHALCONE-11'-O-COUMARATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H26O7
InChI InChI=1S/C29H26O7/c1-19(18-36-28(34)17-8-21-5-11-23(31)12-6-21)2-13-24-27(33)16-14-25(29(24)35)26(32)15-7-20-3-9-22(30)10-4-20/h2-12,14-17,30-31,33,35H,13,18H2,1H3/b15-7+,17-8+,19-2-
InChIKey YKTQNXNBVRMYNF-VFZUQKNSSA-N
Literature Reference Author M.I.CHUNG,M.H.LAI,M.H.YEN,R.R.WU,C.N.LIN
Literature Reference Citation PHYTOCHEM.,44,943(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00644-9
Molecular Weight 486.521 g/mol
Solvent ACETONE-D6
Source File Reference UWPA357