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Baicalin
SpectraBase Compound ID 7paVRSmgiAi
InChI InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1
InChIKey IKIIZLYTISPENI-ZFORQUDYSA-N
Mol Weight 446.36 g/mol
Molecular Formula C21H18O11
Exact Mass 446.084911 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 666fvPKWbrq
Name BAICALIN;5,6,7-TRIHYDROXY-FLAVONE-7-O-BETA-D-GLUCOPYRANOSIDURONATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18O11
InChI InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1
InChIKey IKIIZLYTISPENI-ZFORQUDYSA-N
Literature Reference Author M.WOLNIAK,J.OSZMIANSKI,I.WAWER
Literature Reference Citation MAGN.RES.CHEM.,46,215(2008)
Literature Reference DOI 10.1002/mrc.2165
Molecular Weight 446.367 g/mol
Solvent DMSO-D6
Source File Reference UWIR17582