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ISOSCUTELLARIN;SCUTELLAREIN-6-GLUCURONIDE

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ISOSCUTELLARIN;SCUTELLAREIN-6-GLUCURONIDE
SpectraBase Compound ID 4uLJyPXvdDO
InChI InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)11-5-9(23)13-12(31-11)6-10(24)18(14(13)25)32-21-17(28)15(26)16(27)19(33-21)20(29)30/h1-6,15-17,19,21-22,24-28H,(H,29,30)/t15-,16-,17+,19-,21+/m0/s1
InChIKey HBLWMMBFOKSEKW-BHWDSYMASA-N
Mol Weight 462.36 g/mol
Molecular Formula C21H18O12
Exact Mass 462.079826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1SxpKJF54eA
Name ISOSCUTELLARIN;SCUTELLAREIN-6-GLUCURONIDE
Compound Number M -2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18O12
InChI InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)11-5-9(23)13-12(31-11)6-10(24)18(14(13)25)32-21-17(28)15(26)16(27)19(33-21)20(29)30/h1-6,15-17,19,21-22,24-28H,(H,29,30)/t15-,16-,17+,19-,21+/m0/s1
InChIKey HBLWMMBFOKSEKW-BHWDSYMASA-N
Literature Reference Author X.CHEN,L.CUI,X.DUAN,B.MA,D.ZHONG
Literature Reference Citation DRUG.MET.DISP.,34,1345(2006)
Literature Reference DOI 10.1124/dmd.106.009779
Molecular Weight 462.367 g/mol
Source File Reference UWLU74217