3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-oxidanyl-propanoic acid

Systemtic Name: 3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-oxidanyl-propanoic acid Openeye Name: 3-(2-amino-6-oxo-3H-purin-9-yl)-2-hydroxy-propanoic acid CAS Name: 3-(2-amino-6-oxo-3H-purin-9-yl)-2-hydroxypropanoic acid IUPAC Name: 3-(2-amino-6-oxo-3H-purin-9-yl)-2-hydroxypropanoic acid Traditional Name: 3-(2-amino-6-keto-3H-purin-9-yl)-2-hydroxy-propionic acid Formula: C8H9N5O4 MolecularWeight: 239.18816

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CC(C(=O)O)O)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CC(C(=O)O)O)NC(=NC2=O)N

InChI

InChI=1S/C8H9N5O4/c9-8-11-5-4(6(15)12-8)10-2-13(5)1-3(14)7(16)17/h2-3,14H,1H2,(H,16,17)(H3,9,11,12,15)