3-oxidanyl-2-(5H-purin-6-ylcarbamoylamino)butanoic acid

Systemtic Name: 3-oxidanyl-2-(5H-purin-6-ylcarbamoylamino)butanoic acid Openeye Name: 3-hydroxy-2-(5H-purin-6-ylcarbamoylamino)butanoic acid CAS Name: 3-hydroxy-2-[[oxo-(5H-purin-6-ylamino)methyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-(5H-purin-6-ylcarbamoylamino)butanoic acid Traditional Name: 3-hydroxy-2-(5H-purin-6-ylcarbamoylamino)butyric acid Formula: C10H12N6O4 MolecularWeight: 280.24008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N6O4/c1-4(17)5(9(18)19)15-10(20)16-8-6-7(12-2-11-6)13-3-14-8/h2-6,17H,1H3,(H,18,19)(H2,11,12,13,14,15,16,20)