[3-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)oxymethyl]-4-oxidanyl-butyl]phosphonic acid

Systemtic Name: [3-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)oxymethyl]-4-oxidanyl-butyl]phosphonic acid Openeye Name: [3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxymethyl]-4-hydroxy-butyl]phosphonic acid CAS Name: [3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxymethyl]-4-hydroxybutyl]phosphonic acid IUPAC Name: [3-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxymethyl]-4-hydroxybutyl]phosphonic acid Traditional Name: [3-[(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)oxymethyl]-4-hydroxy-butyl]phosphonic acid Formula: C10H18N5O6P MolecularWeight: 335.253581

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2=C(N1OCC(CCP(=O)(O)O)CO)NC(=NC2=O)N

Isomeric SMILES

C1NC2=C(N1OCC(CCP(=O)(O)O)CO)NC(=NC2=O)N

InChI

InChI=1S/C10H18N5O6P/c11-10-13-8-7(9(17)14-10)12-5-15(8)21-4-6(3-16)1-2-22(18,19)20/h6,12,16H,1-5H2,(H2,18,19,20)(H3,11,13,14,17)