2-(6-azanylidene-1-oxidanyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol hydrate

Systemtic Name: 2-(6-azanylidene-1-oxidanyl-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol hydrate Openeye Name: 2-(1-hydroxy-6-imino-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol hydrate CAS Name: 2-(1-hydroxy-6-imino-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol hydrate IUPAC Name: 2-(1-hydroxy-6-iminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol hydrate Traditional Name: 2-(1-hydroxy-6-imino-purin-9-yl)-5-methylol-tetrahydrofuran-3,4-diol hydrate Formula: C10H15N5O6 MolecularWeight: 301.256

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=CN(C2=N)O.O

Isomeric SMILES

C1=NC2=C(N1C3C(C(C(O3)CO)O)O)N=CN(C2=N)O.O

InChI

InChI=1S/C10H13N5O5.H2O/c11-8-5-9(13-3-15(8)19)14(2-12-5)10-7(18)6(17)4(1-16)20-10;/h2-4,6-7,10-11,16-19H,1H2;1H2