[9-[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purin-6-yl]-trimethyl-azanium

Systemtic Name: [9-[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purin-6-yl]-trimethyl-azanium Openeye Name: [9-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-yl]-trimethyl-ammonium CAS Name: [9-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-purinyl]-trimethylammonium IUPAC Name: [9-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]-trimethylazanium Traditional Name: [9-[(2S,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]purin-6-yl]-trimethyl-ammonium Formula: C13H20N5O3+ MolecularWeight: 294.3296

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=NC=NC2=C1N=CN2C3CC(C(O3)CO)O

Isomeric SMILES

C[N+](C)(C)C1=NC=NC2=C1N=CN2[C@@H]3C[C@@H]([C@H](O3)CO)O

InChI

InChI=1S/C13H20N5O3/c1-18(2,3)13-11-12(14-6-15-13)17(7-16-11)10-4-8(20)9(5-19)21-10/h6-10,19-20H,4-5H2,1-3H3/q+1/t8-,9+,10-/m0/s1