[(2S)-1-(6-azanyl-6,7-dihydropurin-1-yl)-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-(6-azanyl-6,7-dihydropurin-1-yl)-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[(6-amino-6,7-dihydropurin-1-yl)methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-(6-amino-6,7-dihydropurin-1-yl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-(6-amino-6,7-dihydropurin-1-yl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[(6-amino-6,7-dihydropurin-1-yl)methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C9H16N5O5P MolecularWeight: 305.227601

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(N(C=N2)CC(CO)OCP(=O)(O)O)N

Isomeric SMILES

C1=NC2=C(N1)C(N(C=N2)C[C@@H](CO)OCP(=O)(O)O)N

InChI

InChI=1S/C9H16N5O5P/c10-8-7-9(12-3-11-7)13-4-14(8)1-6(2-15)19-5-20(16,17)18/h3-4,6,8,15H,1-2,5,10H2,(H,11,12)(H2,16,17,18)/t6-,8?/m0/s1