2-azanyl-9-[(1R,2S,3S,4S)-2-fluoranyl-3,4-bis(hydroxymethyl)cyclopentyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(1R,2S,3S,4S)-2-fluoranyl-3,4-bis(hydroxymethyl)cyclopentyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(1R,2S,3S,4S)-2-fluoro-3,4-bis(hydroxymethyl)cyclopentyl]-3H-purin-6-one CAS Name: 2-amino-9-[(1R,2S,3S,4S)-2-fluoro-3,4-bis(hydroxymethyl)cyclopentyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(1R,2S,3S,4S)-2-fluoro-3,4-bis(hydroxymethyl)cyclopentyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(1R,2S,3S,4S)-2-fluoro-3,4-dimethylol-cyclopentyl]-3H-purin-6-one Formula: C12H16FN5O3 MolecularWeight: 297.285543

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1N2C=NC3=C2NC(=NC3=O)N)F)CO)CO

Isomeric SMILES

C1[C@@H]([C@H]([C@@H]([C@@H]1N2C=NC3=C2NC(=NC3=O)N)F)CO)CO

InChI

InChI=1S/C12H16FN5O3/c13-8-6(3-20)5(2-19)1-7(8)18-4-15-9-10(18)16-12(14)17-11(9)21/h4-8,19-20H,1-3H2,(H3,14,16,17,21)/t5-,6-,7-,8+/m1/s1