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QUINQUANGULIN-6-O-BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 8N5vxw6GMpL
InChI InChI=1S/C27H32O14/c1-10-4-13(29)19-15(39-10)5-12-11(2)14(36-3)6-16(18(12)21(19)31)40-25-23(33)22(32)20(30)17(41-25)7-37-26-24(34)27(35,8-28)9-38-26/h4-6,17,20,22-26,28,30-35H,7-9H2,1-3H3/t17-,20-,22+,23-,24+,25-,26-,27-/m1/s1
InChIKey OILHXJPQNHMBHT-WIEAWUDUSA-N
Mol Weight 580.5 g/mol
Molecular Formula C27H32O14
Exact Mass 580.179206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FgRlIGxD88f
Name QUINQUANGULIN-6-O-BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32O14
InChI InChI=1S/C27H32O14/c1-10-4-13(29)19-15(39-10)5-12-11(2)14(36-3)6-16(18(12)21(19)31)40-25-23(33)22(32)20(30)17(41-25)7-37-26-24(34)27(35,8-28)9-38-26/h4-6,17,20,22-26,28,30-35H,7-9H2,1-3H3/t17-,20-,22+,23-,24+,25-,26-,27-/m1/s1
InChIKey OILHXJPQNHMBHT-WIEAWUDUSA-N
Literature Reference Author X.C.LI,D.C.DUNBAR,H.N.ELSOHLY,M.R.JACOB,A.C.NIMROD,L.A.WALKE R,A.M.CLARK
Literature Reference Citation J.NAT.PROD.,64,1153(2001)
Literature Reference DOI 10.1021/np010173h
Molecular Weight 580.543 g/mol
Solvent DMSO-D6
Source File Reference UWSI1882