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CAICOINE;4'-O-METHYL-8-O-SULPHATE-ISOSCUTELLAREIN

View entire compound with spectra: 1 NMR

CAICOINE;4'-O-METHYL-8-O-SULPHATE-ISOSCUTELLAREIN
SpectraBase Compound ID Acmg4iVgRDo
InChI InChI=1S/C16H12O9S/c1-23-9-4-2-8(3-5-9)13-7-11(18)14-10(17)6-12(19)15(16(14)24-13)25-26(20,21)22/h2-7,17,19H,1H3,(H,20,21,22)
InChIKey OZLWLHIZJMOEQI-UHFFFAOYSA-N
Mol Weight 380.32 g/mol
Molecular Formula C16H12O9S
Exact Mass 380.020203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8szL1JnzmKj
Name CAICOINE;4'-O-METHYL-8-O-SULPHATE-ISOSCUTELLAREIN
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12O9S
InChI InChI=1S/C16H12O9S/c1-23-9-4-2-8(3-5-9)13-7-11(18)14-10(17)6-12(19)15(16(14)24-13)25-26(20,21)22/h2-7,17,19H,1H3,(H,20,21,22)
InChIKey OZLWLHIZJMOEQI-UHFFFAOYSA-N
Literature Reference Author Y.C.F.TELES,C.C.R.HORTA,M.D.F.AGRA,W.SIHERI,M.BOYD,J.O.IGOLI ,A.I.GRAY,M.D.F.V.D.
Literature Reference Citation MOLECULES,20,20161(2015)
Literature Reference DOI 10.3390/molecules201119685
Molecular Weight 380.326 g/mol
Solvent DMSO-D6
Source File Reference UWPA6049