[[4-(6-aminopurin-9-yl)-3-(hydroxymethyl)oxetan-2-yl]-oxidanyl-methyl]phosphonic acid

Systemtic Name: [[4-(6-aminopurin-9-yl)-3-(hydroxymethyl)oxetan-2-yl]-oxidanyl-methyl]phosphonic acid Openeye Name: [[4-(6-aminopurin-9-yl)-3-(hydroxymethyl)oxetan-2-yl]-hydroxy-methyl]phosphonic acid CAS Name: [[4-(6-aminopurin-9-yl)-3-(hydroxymethyl)-2-oxetanyl]-hydroxymethyl]phosphonic acid IUPAC Name: [[4-(6-aminopurin-9-yl)-3-(hydroxymethyl)oxetan-2-yl]-hydroxymethyl]phosphonic acid Traditional Name: [(4-adenin-9-yl-3-methylol-oxetan-2-yl)-hydroxy-methyl]phosphonic acid Formula: C10H14N5O6P MolecularWeight: 331.221821

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(O3)C(O)P(=O)(O)O)CO

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C3C(C(O3)C(O)P(=O)(O)O)CO

InChI

InChI=1S/C10H14N5O6P/c11-7-5-8(13-2-12-7)15(3-14-5)9-4(1-16)6(21-9)10(17)22(18,19)20/h2-4,6,9-10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)