2-azanyl-8-(dioxidanyl)-9-[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-8-(dioxidanyl)-9-[(2S,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-8-hydroperoxy-9-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-8-hydroperoxy-9-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-8-hydroperoxy-9-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-8-hydroperoxy-9-[(2S,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C10H13N5O6 MolecularWeight: 299.24012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C3=C(C(=O)N=C(N3)N)N=C2OO)CO)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@@H]1N2C3=C(C(=O)N=C(N3)N)N=C2OO)CO)O

InChI

InChI=1S/C10H13N5O6/c11-9-13-7-6(8(18)14-9)12-10(21-19)15(7)5-1-3(17)4(2-16)20-5/h3-5,16-17,19H,1-2H2,(H3,11,13,14,18)/t3-,4+,5-/m0/s1