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3-Methyl-2-(N-phenoxyacetylamino)-5-(2',3',5'-tri-O-benzyl-.beta.,D-ribofuranosyl)pyridine
SpectraBase Compound ID 1djowCeS9zB
InChI InChI=1S/C40H40N2O6/c1-29-22-33(23-41-40(29)42-36(43)28-45-34-20-12-5-13-21-34)37-39(47-26-32-18-10-4-11-19-32)38(46-25-31-16-8-3-9-17-31)35(48-37)27-44-24-30-14-6-2-7-15-30/h2-23,35,37-39H,24-28H2,1H3,(H,41,42,43)/t35-,37+,38-,39+/m1/s1
InChIKey BNFPUYDVXJUMKG-ZACWFTDDSA-N
Mol Weight 644.8 g/mol
Molecular Formula C40H40N2O6
Exact Mass 644.288637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Qjvtjp1i3X
Name 3-Methyl-2-(N-phenoxyacetylamino)-5-(2',3',5'-tri-O-benzyl-.beta.,D-ribofuranosyl)pyridine
Alternate Name(s) 2-[N-(Phenoxyacetyl)amino]-5-(2',3',5'-tri-O-benzyl-.beta.-D-ribofuranosyl)-3-methylpyridine N-{5-[(2S,3S,4R,5R)-3,4-bis(benzyloxy)-5-[(benzyloxy)methyl]oxolan-2-yl]-3-methylpyridin-2-yl}-2-phenoxyacetamide
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Formula C40H40N2O6
InChI InChI=1S/C40H40N2O6/c1-29-22-33(23-41-40(29)42-36(43)28-45-34-20-12-5-13-21-34)37-39(47-26-32-18-10-4-11-19-32)38(46-25-31-16-8-3-9-17-31)35(48-37)27-44-24-30-14-6-2-7-15-30/h2-23,35,37-39H,24-28H2,1H3,(H,41,42,43)/t35-,37+,38-,39+/m1/s1
InChIKey BNFPUYDVXJUMKG-ZACWFTDDSA-N
Molecular Weight 644.768 g/mol
SMILES N(c1ncc([C@@]2(O[C@@]([C@]([C@]2(OCc2ccccc2)[H])(OCc2ccccc2)[H])(COCc2ccccc2)[H])[H])cc1C)C(=O)COc1ccccc1
SPLASH splash10-0pkc-9710000000-58c04089dcfeca45a049
Source of Spectrum C-119-5506-0
Wiley ID 760333