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PENTAACETYL-4-O-BETA-D-GLUCOPYRANOSYL-CAFFEIC-ACID

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PENTAACETYL-4-O-BETA-D-GLUCOPYRANOSYL-CAFFEIC-ACID
SpectraBase Compound ID 1A7DDZP3g4L
InChI InChI=1S/C25H28O14/c1-12(26)33-11-20-22(35-14(3)28)23(36-15(4)29)24(37-16(5)30)25(39-20)38-18-8-6-17(7-9-21(31)32)10-19(18)34-13(2)27/h6-10,20,22-25H,11H2,1-5H3,(H,31,32)/b9-7+/t20-,22-,23+,24-,25-/m1/s1
InChIKey FRVRBJBYWMVAAJ-WYCVXAHCSA-N
Mol Weight 552.49 g/mol
Molecular Formula C25H28O14
Exact Mass 552.147906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYIPHym4qzn
Name PENTAACETYL-4-O-BETA-D-GLUCOPYRANOSYL-CAFFEIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O14
InChI InChI=1S/C25H28O14/c1-12(26)33-11-20-22(35-14(3)28)23(36-15(4)29)24(37-16(5)30)25(39-20)38-18-8-6-17(7-9-21(31)32)10-19(18)34-13(2)27/h6-10,20,22-25H,11H2,1-5H3,(H,31,32)/b9-7+/t20-,22-,23+,24-,25-/m1/s1
InChIKey FRVRBJBYWMVAAJ-WYCVXAHCSA-N
Literature Reference Author E.NYANDAT,E.RWEKIKA,C.GALEFFI,G.PALAZZINO,M.NICOLETTI
Literature Reference Citation PHYTOCHEM.,33,1493(1993)
Literature Reference DOI 10.1016/0031-9422(93)85118-B
Molecular Weight 552.489 g/mol
Solvent CDCl3