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3-(4-HYDROXY-3-METHOXYPHENYL)-PROPANE-1,2-DIOL-2-O-BETA-D-(6-O-GALLOYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID JEu8Zgp8gpM
InChI InChI=1S/C23H28O13/c1-33-16-5-10(2-3-13(16)25)4-12(8-24)35-23-21(31)20(30)19(29)17(36-23)9-34-22(32)11-6-14(26)18(28)15(27)7-11/h2-3,5-7,12,17,19-21,23-31H,4,8-9H2,1H3/t12?,17-,19-,20+,21-,23-/m1/s1
InChIKey DNVSCVOVXAMHOG-ZPHFBNLKSA-N
Mol Weight 512.46 g/mol
Molecular Formula C23H28O13
Exact Mass 512.152991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9qHN9GmHyxF
Name 3-(4-HYDROXY-3-METHOXYPHENYL)-PROPANE-1,2-DIOL-2-O-BETA-D-(6-O-GALLOYL)-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H28O13
InChI InChI=1S/C23H28O13/c1-33-16-5-10(2-3-13(16)25)4-12(8-24)35-23-21(31)20(30)19(29)17(36-23)9-34-22(32)11-6-14(26)18(28)15(27)7-11/h2-3,5-7,12,17,19-21,23-31H,4,8-9H2,1H3/t12?,17-,19-,20+,21-,23-/m1/s1
InChIKey DNVSCVOVXAMHOG-ZPHFBNLKSA-N
Literature Reference Author H.KIKUZAKI,A.SATO,Y.MAYAHARA,N.NAKATANI
Literature Reference Citation J.NAT.PROD.,63,749(2000)
Literature Reference DOI 10.1021/np9906121
Molecular Weight 512.468 g/mol
Solvent ACETONE-D6