4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)butanoic acid

Systemtic Name: 4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)butanoic acid Openeye Name: 4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butanoic acid CAS Name: 4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butanoic acid IUPAC Name: 4-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)butanoic acid Traditional Name: 4-(2-amino-6-keto-3H-purin-9-yl)-2-methylol-butyric acid Formula: C10H13N5O4 MolecularWeight: 267.24132

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCC(CO)C(=O)O)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CCC(CO)C(=O)O)NC(=NC2=O)N

InChI

InChI=1S/C10H13N5O4/c11-10-13-7-6(8(17)14-10)12-4-15(7)2-1-5(3-16)9(18)19/h4-5,16H,1-3H2,(H,18,19)(H3,11,13,14,17)