2-(hydroxymethyl)-5-purin-9-yl-oxolane-3,4-diol hydrate

Systemtic Name: 2-(hydroxymethyl)-5-purin-9-yl-oxolane-3,4-diol hydrate Openeye Name: 2-(hydroxymethyl)-5-purin-9-yl-tetrahydrofuran-3,4-diol hydrate CAS Name: 2-(hydroxymethyl)-5-(9-purinyl)oxolane-3,4-diol hydrate IUPAC Name: 2-(hydroxymethyl)-5-purin-9-yloxolane-3,4-diol hydrate Traditional Name: 2-methylol-5-purin-9-yl-tetrahydrofuran-3,4-diol hydrate Formula: C10H14N4O5 MolecularWeight: 270.24196

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)CO)O)O.O

Isomeric SMILES

C1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)CO)O)O.O

InChI

InChI=1S/C10H12N4O4.H2O/c15-2-6-7(16)8(17)10(18-6)14-4-13-5-1-11-3-12-9(5)14;/h1,3-4,6-8,10,15-17H,2H2;1H2