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5-O-METHYLGENISTEIN-7-O-BETA-D-APIOFURANOSYL-(1->6)-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 2B0RtgpDv4L
InChI InChI=1S/C27H30O14/c1-36-16-6-14(7-17-19(16)20(30)15(8-37-17)12-2-4-13(29)5-3-12)40-25-23(33)22(32)21(31)18(41-25)9-38-26-24(34)27(35,10-28)11-39-26/h2-8,18,21-26,28-29,31-35H,9-11H2,1H3/t18-,21-,22+,23-,24+,25-,26-,27-/m1/s1
InChIKey IHLMTWAVWALTCT-NRIIMPDMSA-N
Mol Weight 578.52 g/mol
Molecular Formula C27H30O14
Exact Mass 578.163556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 39V5KCdX8W5
Name 5-O-METHYLGENISTEIN-7-O-BETA-D-APIOFURANOSYL-(1->6)-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H30O14
InChI InChI=1S/C27H30O14/c1-36-16-6-14(7-17-19(16)20(30)15(8-37-17)12-2-4-13(29)5-3-12)40-25-23(33)22(32)21(31)18(41-25)9-38-26-24(34)27(35,10-28)11-39-26/h2-8,18,21-26,28-29,31-35H,9-11H2,1H3/t18-,21-,22+,23-,24+,25-,26-,27-/m1/s1
InChIKey IHLMTWAVWALTCT-NRIIMPDMSA-N
Literature Reference Author W.G.MA,Y.FUKUSHI,K.HOSTETTMANN,S.TAHARA
Literature Reference Citation PHYTOCHEM.,49,251(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00950-3
Molecular Weight 578.527 g/mol
Solvent CD3OD
Source File Reference UWLU111