4-azanyl-1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-1,3-diazinan-2-one hydrate

Systemtic Name: 4-azanyl-1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-1,3-diazinan-2-one hydrate Openeye Name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]hexahydropyrimidin-2-one hydrate CAS Name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-1,3-diazinan-2-one hydrate IUPAC Name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-diazinan-2-one hydrate Traditional Name: 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]hexahydropyrimidin-2-one hydrate Formula: C9H19N3O5 MolecularWeight: 249.26426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)NC1N)C2CC(C(O2)CO)O.O

Isomeric SMILES

C1CN(C(=O)NC1N)[C@H]2C[C@@H]([C@H](O2)CO)O.O

InChI

InChI=1S/C9H17N3O4.H2O/c10-7-1-2-12(9(15)11-7)8-3-5(14)6(4-13)16-8;/h5-8,13-14H,1-4,10H2,(H,11,15);1H2/t5-,6+,7?,8+;/m0./s1