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9-[3-O-BENZYL-4-C-(HYDROXYMETHYL)-ALPHA-L-ERYTHRO-PENTOFURANOSYL]-6-N-BENZOYLADENINE
SpectraBase Compound ID 5nLDDGWVbVR
InChI InChI=1S/C25H25N5O6/c31-12-25(13-32)20(35-11-16-7-3-1-4-8-16)19(33)24(36-25)30-15-28-18-21(26-14-27-22(18)30)29-23(34)17-9-5-2-6-10-17/h1-10,14-15,19-20,24,31-33H,11-13H2,(H,26,27,29,34)/t19-,20+,24+/m1/s1
InChIKey ROBATRPVWAAGOX-NMMYMHLASA-N
Mol Weight 491.5 g/mol
Molecular Formula C25H25N5O6
Exact Mass 491.180484 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KaqX5U8uCG4
Name 9-[3-O-BENZYL-4-C-(HYDROXYMETHYL)-ALPHA-L-ERYTHRO-PENTOFURANOSYL]-6-N-BENZOYLADENINE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H25N5O6
InChI InChI=1S/C25H25N5O6/c31-12-25(13-32)20(35-11-16-7-3-1-4-8-16)19(33)24(36-25)30-15-28-18-21(26-14-27-22(18)30)29-23(34)17-9-5-2-6-10-17/h1-10,14-15,19-20,24,31-33H,11-13H2,(H,26,27,29,34)/t19-,20+,24+/m1/s1
InChIKey ROBATRPVWAAGOX-NMMYMHLASA-N
Literature Reference Author M.D.SORENSEN,L.KVAERNO,T.BRYLD,A.E.HAKANSSON,B.VERBEURE,G.GA UBERT,P.HERDEWIJN,J.
Literature Reference Citation J.AM.CHEM.SOC.,124,2164(2002)
Literature Reference DOI 10.1021/ja0168763
Molecular Weight 491.503 g/mol
Sample ID 47835
Solvent DMSO-D6