(3S,4R,5R)-2-(6-azanyl-2-hexoxy-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: (3S,4R,5R)-2-(6-azanyl-2-hexoxy-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: (3S,4R,5R)-2-(6-amino-2-hexoxy-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: (3S,4R,5R)-2-(6-amino-2-hexoxy-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: (3S,4R,5R)-2-(6-amino-2-hexoxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: (3S,4R,5R)-2-(6-amino-2-hexoxy-purin-9-yl)-5-methylol-tetrahydrofuran-3,4-diol Formula: C16H25N5O5 MolecularWeight: 367.4002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O

Isomeric SMILES

CCCCCCOC1=NC2=C(C(=N1)N)N=CN2C3[C@H]([C@H]([C@H](O3)CO)O)O

InChI

InChI=1S/C16H25N5O5/c1-2-3-4-5-6-25-16-19-13(17)10-14(20-16)21(8-18-10)15-12(24)11(23)9(7-22)26-15/h8-9,11-12,15,22-24H,2-7H2,1H3,(H2,17,19,20)/t9-,11+,12+,15?/m1/s1