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BIOCHANIN-A-7-O-BETA-D-APIOFURANOSYL-(1->5)-BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 5SzSNJ8zSul
InChI InChI=1S/C32H38O18/c1-43-15-4-2-14(3-5-15)17-8-44-19-7-16(6-18(34)21(19)22(17)35)49-28-25(38)24(37)23(36)20(50-28)9-45-29-27(40)32(42,12-47-29)13-48-30-26(39)31(41,10-33)11-46-30/h2-8,20,23-30,33-34,36-42H,9-13H2,1H3/t20-,23-,24+,25-,26+,27+,28-,29-,30+,31-,32+/m1/s1
InChIKey CKLMBUIIPNQRLI-DJSJNSIOSA-N
Mol Weight 710.6 g/mol
Molecular Formula C32H38O18
Exact Mass 710.205814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4zqu2VGaR7K
Name BIOCHANIN-A-7-O-[BETA-D-APIOFURANOSYL-(1->5)-BETA-D-APIOFURANOSYL-(1->6)-BETA-GLUCOPYRANOSIDE]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H38O18
InChI InChI=1S/C32H38O18/c1-43-15-4-2-14(3-5-15)17-8-44-19-7-16(6-18(34)21(19)22(17)35)49-28-25(38)24(37)23(36)20(50-28)9-45-29-27(40)32(42,12-47-29)13-48-30-26(39)31(41,10-33)11-46-30/h2-8,20,23-30,33-34,36-42H,9-13H2,1H3/t20-,23-,24+,25-,26+,27+,28-,29-,30+,31-,32+/m1/s1
InChIKey CKLMBUIIPNQRLI-DJSJNSIOSA-N
Literature Reference Author S.F.FARAG,A.S.AHMED,K.TERASHIMA,Y.TAKAYA,M.NIWA
Literature Reference Citation PHYTOCHEM.,57,1263(2001)
Literature Reference DOI 10.1016/S0031-9422(01)00195-9
Molecular Weight 710.643 g/mol
Solvent DMSO-D6
Source File Reference UWVN2448