[9-[4-oxidanyl-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl] dihydrogen phosphate

Systemtic Name: [9-[4-oxidanyl-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl] dihydrogen phosphate Openeye Name: [9-[4-hydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]purin-6-yl] dihydrogen phosphate CAS Name: [9-[4-hydroxy-5-(phosphonooxymethyl)-2-oxolanyl]-6-purinyl] dihydrogen phosphate IUPAC Name: [9-[4-hydroxy-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl] dihydrogen phosphate Traditional Name: [9-[4-hydroxy-5-(phosphonooxymethyl)tetrahydrofuran-2-yl]purin-6-yl] dihydrogen phosphate Formula: C10H14N4O10P2 MolecularWeight: 412.186482

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3OP(=O)(O)O)COP(=O)(O)O)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3OP(=O)(O)O)COP(=O)(O)O)O

InChI

InChI=1S/C10H14N4O10P2/c15-5-1-7(23-6(5)2-22-25(16,17)18)14-4-13-8-9(14)11-3-12-10(8)24-26(19,20)21/h3-7,15H,1-2H2,(H2,16,17,18)(H2,19,20,21)