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5'-O-[6-O-(3-HYDROXY-3-METHYL-4-CARBOXY-BUTANOYL)-BETA-D-GLUCOPYRANOSYL)]-PYRIDOXINE
SpectraBase Compound ID ACKyYZUV0H7
InChI InChI=1S/C20H29NO12/c1-9-15(26)11(6-22)10(5-21-9)7-32-19-18(29)17(28)16(27)12(33-19)8-31-14(25)4-20(2,30)3-13(23)24/h5,12,16-19,22,26-30H,3-4,6-8H2,1-2H3,(H,23,24)/t12-,16-,17+,18-,19-,20?/m1/s1
InChIKey QSGUNAASDPWTRZ-GYGADRKKSA-N
Mol Weight 475.45 g/mol
Molecular Formula C20H29NO12
Exact Mass 475.168975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Be8NbsIaRE
Name 5'-O-[6-O-(3-HYDROXY-3-METHYL-4-CARBOXY-BUTANOYL)-BETA-D-GLUCOPYRANOSYL)]-PYRIDOXINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H29NO12
InChI InChI=1S/C20H29NO12/c1-9-15(26)11(6-22)10(5-21-9)7-32-19-18(29)17(28)16(27)12(33-19)8-31-14(25)4-20(2,30)3-13(23)24/h5,12,16-19,22,26-30H,3-4,6-8H2,1-2H3,(H,23,24)/t12-,16-,17+,18-,19-,20?/m1/s1
InChIKey QSGUNAASDPWTRZ-GYGADRKKSA-N
Literature Reference Author K.TADERA,K.NAGANO,F.YAGI,A.KOBAYASHI,K.IMADA,S.TANAKA
Literature Reference Citation AGR.BIOL.CHEM.,47,1357(1983)
Literature Reference DOI 10.1271/bbb1961.47.1357
Molecular Weight 475.450 g/mol
Solvent D2O
Source File Reference UWIR8625