(2S)-3-[[2-azanyl-6-(cyclopropylamino)purin-9-yl]methyl]-2-phosphonato-oxolan-2-ol

Systemtic Name: (2S)-3-[[2-azanyl-6-(cyclopropylamino)purin-9-yl]methyl]-2-phosphonato-oxolan-2-ol Openeye Name: (2S)-3-[[2-amino-6-(cyclopropylamino)purin-9-yl]methyl]-2-phosphonato-tetrahydrofuran-2-ol CAS Name: (2S)-3-[[2-amino-6-(cyclopropylamino)-9-purinyl]methyl]-2-phosphonato-2-oxolanol IUPAC Name: (2S)-3-[[2-amino-6-(cyclopropylamino)purin-9-yl]methyl]-2-phosphonatooxolan-2-ol Traditional Name: (2S)-3-[[2-amino-6-(cyclopropylamino)purin-9-yl]methyl]-2-phosphonato-tetrahydrofuran-2-ol Formula: C13H17N6O5P-2 MolecularWeight: 368.285041

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=C2N=CN3CC4CCOC4(O)P(=O)([O-])[O-])N

Isomeric SMILES

C1CC1NC2=NC(=NC3=C2N=CN3CC4CCO[C@]4(O)P(=O)([O-])[O-])N

InChI

InChI=1S/C13H19N6O5P/c14-12-17-10(16-8-1-2-8)9-11(18-12)19(6-15-9)5-7-3-4-24-13(7,20)25(21,22)23/h6-8,20H,1-5H2,(H2,21,22,23)(H3,14,16,17,18)/p-2/t7?,13-/m0/s1