3-(7H-purin-6-ylamino)butanoic acid

Systemtic Name: 3-(7H-purin-6-ylamino)butanoic acid Openeye Name: 3-(7H-purin-6-ylamino)butanoic acid CAS Name: 3-(7H-purin-6-ylamino)butanoic acid IUPAC Name: 3-(7H-purin-6-ylamino)butanoic acid Traditional Name: 3-(7H-purin-6-ylamino)butyric acid Formula: C9H11N5O2 MolecularWeight: 221.21594

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC1=NC=NC2=C1NC=N2

Isomeric SMILES

CC(CC(=O)O)NC1=NC=NC2=C1NC=N2

InChI

InChI=1S/C9H11N5O2/c1-5(2-6(15)16)14-9-7-8(11-3-10-7)12-4-13-9/h3-5H,2H2,1H3,(H,15,16)(H2,10,11,12,13,14)