2-azanyl-3-(1H-imidazol-5-yl)propanoic acid; 7H-purin-6-amine

Systemtic Name: 2-azanyl-3-(1H-imidazol-5-yl)propanoic acid; 7H-purin-6-amine Openeye Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 7H-purin-6-amine CAS Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 7H-purin-6-amine IUPAC Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 7H-purin-6-amine Traditional Name: 7H-adenine; 2-amino-3-(1H-imidazol-5-yl)propionic acid Formula: C11H14N8O2 MolecularWeight: 290.28126

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)O)N.C1=NC2=C(N1)C(=NC=N2)N

Isomeric SMILES

C1=C(NC=N1)CC(C(=O)O)N.C1=NC2=C(N1)C(=NC=N2)N

InChI

InChI=1S/C6H9N3O2.C5H5N5/c7-5(6(10)11)1-4-2-8-3-9-4;6-4-3-5(9-1-7-3)10-2-8-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11);1-2H,(H3,6,7,8,9,10)