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URGINEANIN_A;(3-R)-3-HYDROXY-3-(4'-METHOXYBENZYL)-5,6,7-TRIMETHOXYCHROMAN-4-ONE
SpectraBase Compound ID 3ivgFwm2gOS
InChI InChI=1S/C20H22O7/c1-23-13-7-5-12(6-8-13)10-20(22)11-27-14-9-15(24-2)17(25-3)18(26-4)16(14)19(20)21/h5-9,22H,10-11H2,1-4H3/t20-/m1/s1
InChIKey XPJYOBQMHUPHPG-HXUWFJFHSA-N
Mol Weight 374.39 g/mol
Molecular Formula C20H22O7
Exact Mass 374.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F23mylnPEEK
Name URGINEANIN_A;(3-R)-3-HYDROXY-3-(4'-METHOXYBENZYL)-5,6,7-TRIMETHOXYCHROMAN-4-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22O7
InChI InChI=1S/C20H22O7/c1-23-13-7-5-12(6-8-13)10-20(22)11-27-14-9-15(24-2)17(25-3)18(26-4)16(14)19(20)21/h5-9,22H,10-11H2,1-4H3/t20-/m1/s1
InChIKey XPJYOBQMHUPHPG-HXUWFJFHSA-N
Literature Reference Author Y.DAI,L.HARINANTENAINA,P.J.BRODIE,M.GOETZ,Y.SHEN,K.TENDYKE,D .G.I.KINGSTON
Literature Reference Citation J.NAT.PROD.,76,865(2013)
Literature Reference DOI 10.1021/np300900a
Molecular Weight 374.390 g/mol
Sample ID 42492
Solvent DMSO-D6