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SINAPYL-9-O-[BETA-D-APIOFURANOSYL-(1->6)]-O-BETA-D-GLUCOPYRANOSIDE;2-(3,4-DIHYDROXY-4-HYDROXYMETHYLTETRAHYDROFURAN-2-YL-OXYMETHYL)-6-[3-(4-HYDROXY-
SpectraBase Compound ID CPqjBaYiJA5
InChI InChI=1S/C22H32O13/c1-30-12-6-11(7-13(31-2)15(12)24)4-3-5-32-20-18(27)17(26)16(25)14(35-20)8-33-21-19(28)22(29,9-23)10-34-21/h3-4,6-7,14,16-21,23-29H,5,8-10H2,1-2H3/b4-3+/t14-,16-,17+,18-,19-,20-,21+,22+/m1/s1
InChIKey AZWYALFKHJLDEH-AALHFFKNSA-N
Mol Weight 504.5 g/mol
Molecular Formula C22H32O13
Exact Mass 504.184291 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CXZGHhfpBXM
Name SINAPYL-9-O-[BETA-D-APIOFURANOSYL-(1->6)]-O-BETA-D-GLUCOPYRANOSIDE;2-(3,4-DIHYDROXY-4-HYDROXYMETHYLTETRAHYDROFURAN-2-YL-OXYMETHYL)-6-[3-(4-HYDROXY-
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O13
InChI InChI=1S/C22H32O13/c1-30-12-6-11(7-13(31-2)15(12)24)4-3-5-32-20-18(27)17(26)16(25)14(35-20)8-33-21-19(28)22(29,9-23)10-34-21/h3-4,6-7,14,16-21,23-29H,5,8-10H2,1-2H3/b4-3+/t14-,16-,17+,18-,19-,20-,21+,22+/m1/s1
InChIKey AZWYALFKHJLDEH-AALHFFKNSA-N
Literature Reference Author R.F.WANG,W.D.XIE,Z.ZHANG,D.M.XING,Y.DING,W.WANG,C.MA,L.J.DU
Literature Reference Citation J.NAT.PROD.,67,2096(2004)
Literature Reference DOI 10.1021/np0498051
Molecular Weight 504.488 g/mol
Solvent DMSO-D6
Source File Reference UWMZ6927