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4',6'-O-BENZYLIDENE-1',3'-DI-O-METHYL-2'-DEOXY-2'-(N(6)-BENZOYLADENIN-9-YL)-D-ALTROPYRANOSIDE
SpectraBase Compound ID IxIN8kvCef5
InChI InChI=1S/C27H27N5O6/c1-34-22-20(27(35-2)37-18-13-36-26(38-21(18)22)17-11-7-4-8-12-17)32-15-30-19-23(28-14-29-24(19)32)31-25(33)16-9-5-3-6-10-16/h3-12,14-15,18,20-22,26-27H,13H2,1-2H3,(H,28,29,31,33)/t18-,20+,21-,22+,26-,27+/m1/s1
InChIKey GNUKPVKPKPPYBX-YMAUANTLSA-N
Mol Weight 517.54 g/mol
Molecular Formula C27H27N5O6
Exact Mass 517.196134 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HoaaKCBkSfa
Name 4',6'-O-BENZYLIDENE-1',3'-DI-O-METHYL-2'-DEOXY-2'-(N(6)-BENZOYLADENIN-9-YL)-D-ALTROPYRANOSIDE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H27N5O6
InChI InChI=1S/C27H27N5O6/c1-34-22-20(27(35-2)37-18-13-36-26(38-21(18)22)17-11-7-4-8-12-17)32-15-30-19-23(28-14-29-24(19)32)31-25(33)16-9-5-3-6-10-16/h3-12,14-15,18,20-22,26-27H,13H2,1-2H3,(H,28,29,31,33)/t18-,20+,21-,22+,26-,27+/m1/s1
InChIKey GNUKPVKPKPPYBX-YMAUANTLSA-N
Literature Reference Author A.VENKATESHAM,D.KACHARE,G.SCHEPERS,J.ROZENSKI,M.FROEYEN,A.V. AERSCHOT
Literature Reference Citation MOLECULES,20,4020(2015)
Literature Reference DOI 10.3390/molecules20034020
Molecular Weight 517.541 g/mol
Solvent CDCl3
Source File Reference UWPA3018