4-[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]oxy-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-4-oxo-butanoic acid CAS Name: 4-[[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl]oxy]-4-oxobutanoic acid IUPAC Name: 4-[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-4-oxobutanoic acid Traditional Name: 4-[5-(2-amino-6-keto-3H-purin-9-yl)-4-hydroxy-2-methylol-tetrahydrofuran-3-yl]oxy-4-keto-butyric acid Formula: C14H17N5O8 MolecularWeight: 383.31348

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(C(O3)CO)OC(=O)CCC(=O)O)O)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1C3C(C(C(O3)CO)OC(=O)CCC(=O)O)O)NC(=NC2=O)N

InChI

InChI=1S/C14H17N5O8/c15-14-17-11-8(12(25)18-14)16-4-19(11)13-9(24)10(5(3-20)26-13)27-7(23)2-1-6(21)22/h4-5,9-10,13,20,24H,1-3H2,(H,21,22)(H3,15,17,18,25)