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3-O-(2-METHOXY-3-METHYL-BUT-3-ENYL)-EMODIN
SpectraBase Compound ID DVgJE1qLtHx
InChI InChI=1S/C21H20O6/c1-10(2)17(26-4)9-27-12-7-14-19(16(23)8-12)21(25)18-13(20(14)24)5-11(3)6-15(18)22/h5-8,17,22-23H,1,9H2,2-4H3
InChIKey TTZZEQICBDRDET-UHFFFAOYSA-N
Mol Weight 368.39 g/mol
Molecular Formula C21H20O6
Exact Mass 368.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID vWEwJLf8Mu
Name 3-O-(2-METHOXY-3-METHYL-BUT-3-ENYL)-EMODIN
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O6
InChI InChI=1S/C21H20O6/c1-10(2)17(26-4)9-27-12-7-14-19(16(23)8-12)21(25)18-13(20(14)24)5-11(3)6-15(18)22/h5-8,17,22-23H,1,9H2,2-4H3
InChIKey TTZZEQICBDRDET-UHFFFAOYSA-N
Literature Reference Author A.R.BILIA,A.W.YUSUF,A.BRACA,A.KEITA,I.MORELLI
Literature Reference Citation J.NAT.PROD.,63,16(2000)
Literature Reference DOI 10.1021/np990226j
Molecular Weight 368.386 g/mol
Solvent CDCl3