9-[5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one; phosphoric acid

Systemtic Name: 9-[5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one; phosphoric acid Openeye Name: 9-[5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one; phosphoric acid CAS Name: 9-[5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one; phosphoric acid IUPAC Name: 9-[5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one; phosphoric acid Traditional Name: 9-(5-methyloltetrahydrofuran-2-yl)-3H-purin-6-one; phosphoric acid Formula: C10H18N4O11P2 MolecularWeight: 432.217642

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1CO)N2C=NC3=C2NC=NC3=O.OP(=O)(O)O.OP(=O)(O)O

Isomeric SMILES

C1CC(OC1CO)N2C=NC3=C2NC=NC3=O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C10H12N4O3.2H3O4P/c15-3-6-1-2-7(17-6)14-5-13-8-9(14)11-4-12-10(8)16;2*1-5(2,3)4/h4-7,15H,1-3H2,(H,11,12,16);2*(H3,1,2,3,4)