[(2S)-1-[2-(aminomethyl)-6-oxidanylidene-3H-purin-9-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-[2-(aminomethyl)-6-oxidanylidene-3H-purin-9-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[[2-(aminomethyl)-6-oxo-3H-purin-9-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-[2-(aminomethyl)-6-oxo-3H-purin-9-yl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-[2-(aminomethyl)-6-oxo-3H-purin-9-yl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[[2-(aminomethyl)-6-keto-3H-purin-9-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C10H16N5O6P MolecularWeight: 333.237701

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CC(CO)OCP(=O)(O)O)NC(=NC2=O)CN

Isomeric SMILES

C1=NC2=C(N1C[C@@H](CO)OCP(=O)(O)O)NC(=NC2=O)CN

InChI

InChI=1S/C10H16N5O6P/c11-1-7-13-9-8(10(17)14-7)12-4-15(9)2-6(3-16)21-5-22(18,19)20/h4,6,16H,1-3,5,11H2,(H,13,14,17)(H2,18,19,20)/t6-/m0/s1