2-azanyl-9-[(3R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(3R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(3R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(3R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-3-yl]-3H-purin-6-one Formula: C10H13N5O4 MolecularWeight: 267.24132

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(O1)CO)O)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

C1[C@H]([C@@H]([C@H](O1)CO)O)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C10H13N5O4/c11-10-13-8-6(9(18)14-10)12-3-15(8)4-2-19-5(1-16)7(4)17/h3-5,7,16-17H,1-2H2,(H3,11,13,14,18)/t4-,5-,7+/m1/s1