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DISCOLORANONE_A;5,2'-DIHYDROXY-3',4'-METHYLENEDIOXY-3'',3''-DIMETHYLPYRANO-[7.8]-ISOFLAVANONE
SpectraBase Compound ID AcuSwDG7b3j
InChI InChI=1S/C21H18O7/c1-21(2)4-3-10-15(28-21)7-14(23)18-19(24)12(8-25-20(10)18)11-5-16-17(6-13(11)22)27-9-26-16/h3-7,12,22-23H,8-9H2,1-2H3
InChIKey RMSBRJLIIWEOOT-UHFFFAOYSA-N
Mol Weight 382.37 g/mol
Molecular Formula C21H18O7
Exact Mass 382.105253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GC7E2tOZIuu
Name DISCOLORANONE_A;5,2'-DIHYDROXY-3',4'-METHYLENEDIOXY-3'',3''-DIMETHYLPYRANO-[7.8]-ISOFLAVANONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18O7
InChI InChI=1S/C21H18O7/c1-21(2)4-3-10-15(28-21)7-14(23)18-19(24)12(8-25-20(10)18)11-5-16-17(6-13(11)22)27-9-26-16/h3-7,12,22-23H,8-9H2,1-2H3
InChIKey RMSBRJLIIWEOOT-UHFFFAOYSA-N
Literature Reference Author Y.W.CHIN,L.K.MDEE,Z.H.MBWAMBO,Q.MI,H.B.CHAI,G.M.CRAGG,S.M.SW ANSON,A.D.KINGHORN
Literature Reference Citation J.NAT.PROD.,69,1649(2006)
Literature Reference DOI 10.1021/np060418w
Molecular Weight 382.370 g/mol
Solvent CDCl3
Source File Reference UWMZ17243