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

Systemtic Name: (3S,4R,5R)-2-(6-azanyl-2-phenethyloxy-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: (3S,4R,5R)-2-(6-amino-2-phenethyloxy-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: (3S,4R,5R)-2-(6-amino-2-phenethyloxy-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: (3S,4R,5R)-2-(6-amino-2-phenethyloxypurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: (3S,4R,5R)-2-(6-amino-2-phenethyloxy-purin-9-yl)-5-methylol-tetrahydrofuran-3,4-diol Formula: C18H21N5O5 MolecularWeight: 387.38984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=NC3=C(C(=N2)N)N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=NC3=C(C(=N2)N)N=CN3C4[C@H]([C@H]([C@H](O4)CO)O)O

InChI

InChI=1S/C18H21N5O5/c19-15-12-16(22-18(21-15)27-7-6-10-4-2-1-3-5-10)23(9-20-12)17-14(26)13(25)11(8-24)28-17/h1-5,9,11,13-14,17,24-26H,6-8H2,(H2,19,21,22)/t11-,13+,14+,17?/m1/s1