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

Systemtic Name: 2-azanyl-9-[(2R,5S)-5-(hydroxymethyl)-4-methylidene-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,5S)-3-hydroxy-5-(hydroxymethyl)-4-methylene-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2R,5S)-3-hydroxy-5-(hydroxymethyl)-4-methylene-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,5S)-3-hydroxy-5-(hydroxymethyl)-4-methylideneoxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,5S)-3-hydroxy-4-methylene-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C11H13N5O4 MolecularWeight: 279.25202

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(OC(C1O)N2C=NC3=C2NC(=NC3=O)N)CO

Isomeric SMILES

C=C1[C@H](O[C@H](C1O)N2C=NC3=C2NC(=NC3=O)N)CO

InChI

InChI=1S/C11H13N5O4/c1-4-5(2-17)20-10(7(4)18)16-3-13-6-8(16)14-11(12)15-9(6)19/h3,5,7,10,17-18H,1-2H2,(H3,12,14,15,19)/t5-,7?,10-/m1/s1