5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol hydrate

Systemtic Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol hydrate Openeye Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol hydrate CAS Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-oxolanol hydrate IUPAC Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol hydrate Traditional Name: 5-adenin-9-yl-2-methylol-tetrahydrofuran-3-ol hydrate Formula: C10H15N5O4 MolecularWeight: 269.2572

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)O.O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)O.O

InChI

InChI=1S/C10H13N5O3.H2O/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7;/h3-7,16-17H,1-2H2,(H2,11,12,13);1H2