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CUCURBITOSIDE-D;4-HYDROXYBENZYL-ALCOHOL-4-O-[5-O-(4-HYDROXY)-BENZOYL]-BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID DqWZTYKPSnF
InChI InChI=1S/C25H30O13/c26-9-13-1-7-16(8-2-13)36-23-20(19(30)18(29)17(10-27)37-23)38-24-21(31)25(33,12-35-24)11-34-22(32)14-3-5-15(28)6-4-14/h1-8,17-21,23-24,26-31,33H,9-12H2/t17-,18-,19+,20-,21+,23-,24+,25-/m1/s1
InChIKey WIMAHNFFARKNJF-KXQNOTADSA-N
Mol Weight 538.5 g/mol
Molecular Formula C25H30O13
Exact Mass 538.168641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5W73Yw4QCLy
Name CUCURBITOSIDE-D;4-HYDROXYBENZYL-ALCOHOL-4-O-[5-O-(4-HYDROXY)-BENZOYL]-BETA-D-APIOFURANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H30O13
InChI InChI=1S/C25H30O13/c26-9-13-1-7-16(8-2-13)36-23-20(19(30)18(29)17(10-27)37-23)38-24-21(31)25(33,12-35-24)11-34-22(32)14-3-5-15(28)6-4-14/h1-8,17-21,23-24,26-31,33H,9-12H2/t17-,18-,19+,20-,21+,23-,24+,25-/m1/s1
InChIKey WIMAHNFFARKNJF-KXQNOTADSA-N
Literature Reference Author K.KOIKI,W.LI,L.LIU,E.HATA,T.NIKAIDO
Literature Reference Citation CHEM.PHARM.BULL.,53,225(2005)
Literature Reference DOI 10.1248/cpb.53.225
Molecular Weight 538.505 g/mol
Sample ID 54695
Solvent CD3OD