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BOERAVINONE-L;(2S,3S)-5,7,4'-TRIHYDROXY-2,3-DIHYDRO-COUMARONO-CHROMONE-4'-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID LM7QYVAAcU2
InChI InChI=1S/C21H20O11/c22-6-13-16(25)18(27)19(28)21(32-13)29-8-1-2-9-11(5-8)30-20-14(9)17(26)15-10(24)3-7(23)4-12(15)31-20/h1-5,13-14,16,18-25,27-28H,6H2/t13-,14-,16-,18+,19-,20+,21-/m1/s1
InChIKey DZHIUKVEYUSXHE-JMFUCORLSA-N
Mol Weight 448.38 g/mol
Molecular Formula C21H20O11
Exact Mass 448.100561 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6YXZOa3nSUb
Name BOERAVINONE-L;(2S,3S)-5,7,4'-TRIHYDROXY-2,3-DIHYDRO-COUMARONO-CHROMONE-4'-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O11
InChI InChI=1S/C21H20O11/c22-6-13-16(25)18(27)19(28)21(32-13)29-8-1-2-9-11(5-8)30-20-14(9)17(26)15-10(24)3-7(23)4-12(15)31-20/h1-5,13-14,16,18-25,27-28H,6H2/t13-,14-,16-,18+,19-,20+,21-/m1/s1
InChIKey DZHIUKVEYUSXHE-JMFUCORLSA-N
Literature Reference Author T.M.L.DO,A.V.TRUONG,T.G.PINNOCK,L.M.PRATT,S.YAMAMOTO,H.WATAR AI,D.GUILLAUME
Literature Reference Citation CHEM.PHARM.BULL.,61,624(2013)
Literature Reference DOI 10.1248/cpb.c12-01081
Molecular Weight 448.383 g/mol
Source File Reference UWIR3917