[(2S)-1-(2-azanylpurin-9-yl)-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-(2-azanylpurin-9-yl)-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[(2-aminopurin-9-yl)methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-(2-amino-9-purinyl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-(2-aminopurin-9-yl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[(2-aminopurin-9-yl)methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C9H14N5O5P MolecularWeight: 303.211721

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC(=N1)N)N(C=N2)CC(CO)OCP(=O)(O)O

Isomeric SMILES

C1=C2C(=NC(=N1)N)N(C=N2)C[C@@H](CO)OCP(=O)(O)O

InChI

InChI=1S/C9H14N5O5P/c10-9-11-1-7-8(13-9)14(4-12-7)2-6(3-15)19-5-20(16,17)18/h1,4,6,15H,2-3,5H2,(H2,10,11,13)(H2,16,17,18)/t6-/m0/s1