3-methyl-2-(5H-purin-6-ylamino)pentanoic acid

Systemtic Name: 3-methyl-2-(5H-purin-6-ylamino)pentanoic acid Openeye Name: 3-methyl-2-(5H-purin-6-ylamino)pentanoic acid CAS Name: 3-methyl-2-(5H-purin-6-ylamino)pentanoic acid IUPAC Name: 3-methyl-2-(5H-purin-6-ylamino)pentanoic acid Traditional Name: 3-methyl-2-(5H-purin-6-ylamino)valeric acid Formula: C11H15N5O2 MolecularWeight: 249.2691

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC1=NC=NC2=NC=NC21

Isomeric SMILES

CCC(C)C(C(=O)O)NC1=NC=NC2=NC=NC21

InChI

InChI=1S/C11H15N5O2/c1-3-6(2)7(11(17)18)16-10-8-9(13-4-12-8)14-5-15-10/h4-8H,3H2,1-2H3,(H,17,18)(H,12,13,14,15,16)