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1-O-FERULOYL-beta-D-XYLOPYRANOSYL-(1-6)-beta-D-GLUCOPYRANOSIDE
SpectraBase Compound ID A5P2UEc5J2B
InChI InChI=1S/C21H28O13/c1-30-12-6-9(2-4-10(12)22)3-5-14(24)34-21-19(29)17(27)16(26)13(33-21)8-32-20-18(28)15(25)11(23)7-31-20/h2-6,11,13,15-23,25-29H,7-8H2,1H3/b5-3+/t11-,13+,15+,16+,17-,18-,19+,20+,21-/m1/s1
InChIKey ISIAVDYYQSNUOL-ZFWZNHCGSA-N
Mol Weight 488.44 g/mol
Molecular Formula C21H28O13
Exact Mass 488.152991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I8WmEcYx6VG
Name 1-O-FERULOYL-BETA-D-XYLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O13
InChI InChI=1S/C21H28O13/c1-30-12-6-9(2-4-10(12)22)3-5-14(24)34-21-19(29)17(27)16(26)13(33-21)8-32-20-18(28)15(25)11(23)7-31-20/h2-6,11,13,15-23,25-29H,7-8H2,1H3/b5-3+/t11-,13+,15+,16+,17-,18-,19+,20+,21-/m1/s1
InChIKey ISIAVDYYQSNUOL-ZFWZNHCGSA-N
Literature Reference Author K.HASHIMOTO,T.KATSUHARA,K.NIITSU,Y.IKEYA,M.OKADA,H.MITSUHASH I
Literature Reference Citation PHYTOCHEM.,31,2477(1992)
Literature Reference DOI 10.1016/0031-9422(92)83303-G
Molecular Weight 488.446 g/mol
Solvent DMSO-D6
Source File Reference UWLU28813