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4,2',4'-TRIHYDROXY-3'-(3-HYDROXY-3,7-DIMETHYL-6-OCTENYL)-CHALCONE;XANTHOANGELOL-J
SpectraBase Compound ID HIxgDKtgf8F
InChI InChI=1S/C25H30O5/c1-17(2)5-4-15-25(3,30)16-14-21-23(28)13-11-20(24(21)29)22(27)12-8-18-6-9-19(26)10-7-18/h5-13,26,28-30H,4,14-16H2,1-3H3/b12-8+
InChIKey BQRLJINJRBLFJV-XYOKQWHBSA-N
Mol Weight 410.51 g/mol
Molecular Formula C25H30O5
Exact Mass 410.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3AQr5i9FNaL
Name 4,2',4'-TRIHYDROXY-3'-(3-HYDROXY-3,7-DIMETHYL-6-OCTENYL)-CHALCONE;XANTHOANGELOL-J
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O5
InChI InChI=1S/C25H30O5/c1-17(2)5-4-15-25(3,30)16-14-21-23(28)13-11-20(24(21)29)22(27)12-8-18-6-9-19(26)10-7-18/h5-13,26,28-30H,4,14-16H2,1-3H3/b12-8+
InChIKey BQRLJINJRBLFJV-XYOKQWHBSA-N
Literature Reference Author T.AKIHISA,H.TOKUDA,D.HASEGAWA,M.UKIYA,Y.KIMURA,F.ENJO,T.SUZU KI,H.NISHINO
Literature Reference Citation J.NAT.PROD.,69,38(2006)
Literature Reference DOI 10.1021/np058080d
Molecular Weight 410.510 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ16898