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2-(hydroxymethyl)-5-(6-((3-morpholinopropyl)amino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol

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2-(hydroxymethyl)-5-(6-((3-morpholinopropyl)amino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol
SpectraBase Compound ID ElJRPN5cK3X
InChI InChI=1S/C17H26N6O5/c24-8-11-13(25)14(26)17(28-11)23-10-21-12-15(19-9-20-16(12)23)18-2-1-3-22-4-6-27-7-5-22/h9-11,13-14,17,24-26H,1-8H2,(H,18,19,20)/t11-,13-,14-,17-/m1/s1
InChIKey OMJQBMVXORVWFV-LSCFUAHRSA-N
Mol Weight 394.43 g/mol
Molecular Formula C17H26N6O5
Exact Mass 394.196468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IJAHnvKrvlI
Name 2-(Hydroxymethyl)-5-(6-((3-morpholinopropyl)amino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol
Comments Computed using HOSE algorithm
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Exact Mass 394.196467956 u
Formula C17H26N6O5
InChI InChI=1S/C17H26N6O5/c24-8-11-13(25)14(26)17(28-11)23-10-21-12-15(19-9-20-16(12)23)18-2-1-3-22-4-6-27-7-5-22/h9-11,13-14,17,24-26H,1-8H2,(H,18,19,20)/t11-,13-,14-,17-/m1/s1
InChIKey OMJQBMVXORVWFV-LSCFUAHRSA-N
Molecular Weight 394.432 g/mol
SMILES N(C=1C2=C(N([C@]3([C@@]([C@@]([C@](O3)(CO)[H])(O)[H])(O)[H])[H])C=N2)N=CN1)CCCN1CCOCC1