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

Systemtic Name: (2S)-2-azanyl-3-(6-oxidanylidene-3H-purin-9-yl)propanoic acid Openeye Name: (2S)-2-amino-3-(6-oxo-3H-purin-9-yl)propanoic acid CAS Name: (2S)-2-amino-3-(6-oxo-3H-purin-9-yl)propanoic acid IUPAC Name: (2S)-2-amino-3-(6-oxo-3H-purin-9-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(6-keto-3H-purin-9-yl)propionic acid Formula: C8H9N5O3 MolecularWeight: 223.18876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)CC(C(=O)O)N

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)C[C@@H](C(=O)O)N

InChI

InChI=1S/C8H9N5O3/c9-4(8(15)16)1-13-3-12-5-6(13)10-2-11-7(5)14/h2-4H,1,9H2,(H,15,16)(H,10,11,14)/t4-/m0/s1