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7-O-ALPHA-CARBOXYETHYLDAIDZEIN-ETHYLESTER
SpectraBase Compound ID 38JEklcmQdU
InChI InChI=1S/C20H18O6/c1-3-24-20(23)12(2)26-15-8-9-16-18(10-15)25-11-17(19(16)22)13-4-6-14(21)7-5-13/h4-12,21H,3H2,1-2H3/t12-/m0/s1
InChIKey FIBZTJYDEQEKEI-LBPRGKRZSA-N
Mol Weight 354.36 g/mol
Molecular Formula C20H18O6
Exact Mass 354.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4kLiJ0c7Mrt
Name 7-O-ALPHA-CARBOXYETHYLDAIDZEIN-ETHYLESTER
Compound Number 3 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18O6
InChI InChI=1S/C20H18O6/c1-3-24-20(23)12(2)26-15-8-9-16-18(10-15)25-11-17(19(16)22)13-4-6-14(21)7-5-13/h4-12,21H,3H2,1-2H3/t12-/m0/s1
InChIKey FIBZTJYDEQEKEI-LBPRGKRZSA-N
Literature Reference Author G.Y.GAO,D.J.LI,W.M.KEUNG
Literature Reference Citation J.MED.CHEM.,44,3320(2001)
Literature Reference DOI 10.1021/jm0101390
Molecular Weight 354.359 g/mol
Sample ID 40887
Solvent DMSO-D6