2-azanyl-9-[(1S,3S,4S,5R)-3-(hydroxymethyl)-2-methylidene-4,5-bis(oxidanyl)cyclopentyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(1S,3S,4S,5R)-3-(hydroxymethyl)-2-methylidene-4,5-bis(oxidanyl)cyclopentyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(1S,2R,3S,4S)-2,3-dihydroxy-4-(hydroxymethyl)-5-methylene-cyclopentyl]-3H-purin-6-one CAS Name: 2-amino-9-[(1S,2R,3S,4S)-2,3-dihydroxy-4-(hydroxymethyl)-5-methylenecyclopentyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(1S,2R,3S,4S)-2,3-dihydroxy-4-(hydroxymethyl)-5-methylidenecyclopentyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(1S,2R,3S,4S)-2,3-dihydroxy-5-methylene-4-methylol-cyclopentyl]-3H-purin-6-one Formula: C12H15N5O4 MolecularWeight: 293.2786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N5O4/c1-4-5(2-18)8(19)9(20)7(4)17-3-14-6-10(17)15-12(13)16-11(6)21/h3,5,7-9,18-20H,1-2H2,(H3,13,15,16,21)/t5-,7+,8+,9-/m1/s1