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2',3'-[2-METHYL-2-(4-METHYL-3-PENTENYL)-DIHYDROPYRANE]-4,4'-DIHYDROXYCHALCONE;XANTHOANGELOL-I
SpectraBase Compound ID TlrI4QVoUZ
InChI InChI=1S/C25H28O4/c1-17(2)5-4-15-25(3)16-14-21-23(28)13-11-20(24(21)29-25)22(27)12-8-18-6-9-19(26)10-7-18/h5-13,26,28H,4,14-16H2,1-3H3/b12-8+
InChIKey AJTWDECGQXIMQX-XYOKQWHBSA-N
Mol Weight 392.5 g/mol
Molecular Formula C25H28O4
Exact Mass 392.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3DlMqCPqtkH
Name 2',3'-[2-METHYL-2-(4-METHYL-3-PENTENYL)-DIHYDROPYRANE]-4,4'-DIHYDROXYCHALCONE;XANTHOANGELOL-I
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O4
InChI InChI=1S/C25H28O4/c1-17(2)5-4-15-25(3)16-14-21-23(28)13-11-20(24(21)29-25)22(27)12-8-18-6-9-19(26)10-7-18/h5-13,26,28H,4,14-16H2,1-3H3/b12-8+
InChIKey AJTWDECGQXIMQX-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 392.495 g/mol
Solvent CD3OD
Source File Reference UWMZ16897