6-azanyl-9-[2,3-bis(oxidanyl)propyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-9-[2,3-bis(oxidanyl)propyl]-7H-purin-8-one Openeye Name: 6-amino-9-(2,3-dihydroxypropyl)-7H-purin-8-one CAS Name: 6-amino-9-(2,3-dihydroxypropyl)-7H-purin-8-one IUPAC Name: 6-amino-9-(2,3-dihydroxypropyl)-7H-purin-8-one Traditional Name: 6-amino-9-glyceryl-7H-purin-8-one Formula: C8H11N5O3 MolecularWeight: 225.20464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)NC(=O)N2CC(CO)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)NC(=O)N2CC(CO)O

InChI

InChI=1S/C8H11N5O3/c9-6-5-7(11-3-10-6)13(8(16)12-5)1-4(15)2-14/h3-4,14-15H,1-2H2,(H,12,16)(H2,9,10,11)