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QIANHUCOUMARIN-H;3'S-ANGELOYLOXY-4'R-ISOVALERYLOXY-3',4'-DIHYDROSESELIN
SpectraBase Compound ID DSma0AdiH0V
InChI InChI=1S/C24H28O7/c1-7-14(4)23(27)30-22-21(29-18(26)12-13(2)3)19-16(31-24(22,5)6)10-8-15-9-11-17(25)28-20(15)19/h7-11,13,21-22H,12H2,1-6H3/b14-7-/t21-,22+/m0/s1
InChIKey UFUVJROSOIXJGR-ZGTAAAPDSA-N
Mol Weight 428.48 g/mol
Molecular Formula C24H28O7
Exact Mass 428.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3kGlrNeenp7
Name QIANHUCOUMARIN-H;3'S-ANGELOYLOXY-4'R-ISOVALERYLOXY-3',4'-DIHYDROSESELIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H28O7
InChI InChI=1S/C24H28O7/c1-7-14(4)23(27)30-22-21(29-18(26)12-13(2)3)19-16(31-24(22,5)6)10-8-15-9-11-17(25)28-20(15)19/h7-11,13,21-22H,12H2,1-6H3/b14-7-/t21-,22+/m0/s1
InChIKey UFUVJROSOIXJGR-ZGTAAAPDSA-N
Literature Reference Author L.Y.KONG,Y.LI,Z.D.MIN,X.LI,T.R.ZHU
Literature Reference Citation PHYTOCHEM.,41,1423(1996)
Literature Reference DOI 10.1016/0031-9422(95)00783-0
Molecular Weight 428.482 g/mol
Solvent CDCl3
Source File Reference UWLU4440