[(2S)-1-[2-azanyl-6-(methylamino)purin-9-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-[2-azanyl-6-(methylamino)purin-9-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[[2-amino-6-(methylamino)purin-9-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-[2-amino-6-(methylamino)-9-purinyl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-[2-amino-6-(methylamino)purin-9-yl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[[2-amino-6-(methylamino)purin-9-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C10H17N6O5P MolecularWeight: 332.252941

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2CC(CO)OCP(=O)(O)O)N

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2C[C@@H](CO)OCP(=O)(O)O)N

InChI

InChI=1S/C10H17N6O5P/c1-12-8-7-9(15-10(11)14-8)16(4-13-7)2-6(3-17)21-5-22(18,19)20/h4,6,17H,2-3,5H2,1H3,(H2,18,19,20)(H3,11,12,14,15)/t6-/m0/s1