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

Systemtic Name: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one; 2-azanyl-9-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one; 2-amino-9-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one; 2-amino-9-[(2R,5S)-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one; 2-amino-9-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one; 2-amino-9-[(2R,5S)-5-methyloltetrahydrofuran-2-yl]-3H-purin-6-one Formula: C20H26N10O7 MolecularWeight: 518.48324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1CO)N2C=NC3=C2NC(=NC3=O)N.C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)O

Isomeric SMILES

C1C[C@@H](O[C@@H]1CO)N2C=NC3=C2NC(=NC3=O)N.C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=O)N)CO)O

InChI

InChI=1S/C10H13N5O4.C10H13N5O3/c11-10-13-8-7(9(18)14-10)12-3-15(8)6-1-4(17)5(2-16)19-6;11-10-13-8-7(9(17)14-10)12-4-15(8)6-2-1-5(3-16)18-6/h3-6,16-17H,1-2H2,(H3,11,13,14,18);4-6,16H,1-3H2,(H3,11,13,14,17)/t4-,5+,6+;5-,6+/m00/s1