4-azanyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one hydrate

Systemtic Name: 4-azanyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one hydrate Openeye Name: 4-amino-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one hydrate CAS Name: 4-amino-1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-pyrimidinone hydrate IUPAC Name: 4-amino-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one hydrate Traditional Name: 4-amino-1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)pyrimidin-2-one hydrate Formula: C9H15N3O5 MolecularWeight: 245.2325

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)CO)O.O

Isomeric SMILES

C1C(C(OC1N2C=CC(=NC2=O)N)CO)O.O

InChI

InChI=1S/C9H13N3O4.H2O/c10-7-1-2-12(9(15)11-7)8-3-5(14)6(4-13)16-8;/h1-2,5-6,8,13-14H,3-4H2,(H2,10,11,15);1H2