9-[3,4-diethanoyl-3,4-bis(oxidanyl)-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 9-[3,4-diethanoyl-3,4-bis(oxidanyl)-5-(1-oxidanyl-2-oxidanylidene-propyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-oxo-propyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-oxopropyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-oxopropyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[3,4-diacetyl-3,4-dihydroxy-5-(1-hydroxy-2-keto-propyl)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C16H18N4O8 MolecularWeight: 394.33612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1C(C(C(O1)N2C=NC3=C2NC=NC3=O)(C(=O)C)O)(C(=O)C)O)O

Isomeric SMILES

CC(=O)C(C1C(C(C(O1)N2C=NC3=C2NC=NC3=O)(C(=O)C)O)(C(=O)C)O)O

InChI

InChI=1S/C16H18N4O8/c1-6(21)10(24)11-15(26,7(2)22)16(27,8(3)23)14(28-11)20-5-19-9-12(20)17-4-18-13(9)25/h4-5,10-11,14,24,26-27H,1-3H3,(H,17,18,25)