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1-SINAPOYL-2-FERULOYL-GENTIOBIOSE

View entire compound with spectra: 2 NMR

1-SINAPOYL-2-FERULOYL-GENTIOBIOSE
SpectraBase Compound ID 957CSuR4RdW
InChI InChI=1S/C33H40O18/c1-44-18-10-15(4-7-17(18)35)5-8-23(36)50-31-29(42)27(40)22(14-47-32-30(43)28(41)26(39)21(13-34)48-32)49-33(31)51-24(37)9-6-16-11-19(45-2)25(38)20(12-16)46-3/h4-12,21-22,26-35,38-43H,13-14H2,1-3H3/b8-5+,9-6+/t21-,22+,26-,27+,28+,29-,30-,31+,32-,33-/m0/s1
InChIKey QYKVHEQRAXPEEL-YATRAHMWSA-N
Mol Weight 724.7 g/mol
Molecular Formula C33H40O18
Exact Mass 724.221464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IARtUSM0irR
Name 1-SINAPOYL-2-FERULOYL-GENTIOBIOSE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H40O18
InChI InChI=1S/C33H40O18/c1-44-18-10-15(4-7-17(18)35)5-8-23(36)50-31-29(42)27(40)22(14-47-32-30(43)28(41)26(39)21(13-34)48-32)49-33(31)51-24(37)9-6-16-11-19(45-2)25(38)20(12-16)46-3/h4-12,21-22,26-35,38-43H,13-14H2,1-3H3/b8-5+,9-6+/t21-,22+,26-,27+,28+,29-,30-,31+,32-,33-/m0/s1
InChIKey QYKVHEQRAXPEEL-YATRAHMWSA-N
Literature Reference Author X.L.PIAO,H.Y.KIM,T.YOKOZAWA,Y.A.LEE,X.S.PIAO,E.J.CHO
Literature Reference Citation J.NUTR.SCI.VITAM.,51,142(2005)
Literature Reference DOI 10.3177/jnsv.51.142
Molecular Weight 724.670 g/mol
Source File Reference UWBT7174