2-[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanyl-ethanoic acid

Systemtic Name: 2-[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanyl-ethanoic acid Openeye Name: 2-[5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-2-hydroxy-acetic acid CAS Name: 2-[5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxy-2-oxolanyl]-2-hydroxyacetic acid IUPAC Name: 2-[5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyacetic acid Traditional Name: 2-[5-(2-amino-6-keto-3H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-2-hydroxy-acetic acid Formula: C11H13N5O7 MolecularWeight: 327.25022

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(C(O3)C(C(=O)O)O)O)O)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1C3C(C(C(O3)C(C(=O)O)O)O)O)NC(=NC2=O)N

InChI

InChI=1S/C11H13N5O7/c12-11-14-7-2(8(20)15-11)13-1-16(7)9-4(18)3(17)6(23-9)5(19)10(21)22/h1,3-6,9,17-19H,(H,21,22)(H3,12,14,15,20)