3-(2-azanyl-6-pyrrolidin-1-yl-purin-9-yl)-2-oxidanyl-propanoic acid

Systemtic Name: 3-(2-azanyl-6-pyrrolidin-1-yl-purin-9-yl)-2-oxidanyl-propanoic acid Openeye Name: 3-(2-amino-6-pyrrolidin-1-yl-purin-9-yl)-2-hydroxy-propanoic acid CAS Name: 3-[2-amino-6-(1-pyrrolidinyl)-9-purinyl]-2-hydroxypropanoic acid IUPAC Name: 3-(2-amino-6-pyrrolidin-1-ylpurin-9-yl)-2-hydroxypropanoic acid Traditional Name: 3-(2-amino-6-pyrrolidino-purin-9-yl)-2-hydroxy-propionic acid Formula: C12H16N6O3 MolecularWeight: 292.29384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=CN3CC(C(=O)O)O)N

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=CN3CC(C(=O)O)O)N

InChI

InChI=1S/C12H16N6O3/c13-12-15-9(17-3-1-2-4-17)8-10(16-12)18(6-14-8)5-7(19)11(20)21/h6-7,19H,1-5H2,(H,20,21)(H2,13,15,16)