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EMODIN_ACETATE;1,3,8-TRICETOXY-6-METHYLANTHRAQUINONE
SpectraBase Compound ID RaZZj6n2ac
InChI InChI=1S/C21H16O8/c1-9-5-14-18(16(6-9)28-11(3)23)21(26)19-15(20(14)25)7-13(27-10(2)22)8-17(19)29-12(4)24/h5-8H,1-4H3
InChIKey RVPRUQJQDGWKRY-UHFFFAOYSA-N
Mol Weight 396.35 g/mol
Molecular Formula C21H16O8
Exact Mass 396.084517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JULRxRY0ces
Name EMODIN_ACETATE;1,3,8-TRICETOXY-6-METHYLANTHRAQUINONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16O8
InChI InChI=1S/C21H16O8/c1-9-5-14-18(16(6-9)28-11(3)23)21(26)19-15(20(14)25)7-13(27-10(2)22)8-17(19)29-12(4)24/h5-8H,1-4H3
InChIKey RVPRUQJQDGWKRY-UHFFFAOYSA-N
Literature Reference Author C.N.LIN,M.I.CHUNG,C.M.LU
Literature Reference Citation PHYTOCHEM.,29,3903(1990)
Literature Reference DOI 10.1016/0031-9422(90)85356-K
Molecular Weight 396.353 g/mol
Solvent CDCl3
Source File Reference UWMZ19558