5-(6-aminopurin-9-yl)-4-azido-2-(hydroxymethyl)oxolan-3-ol; phosphoric acid

Systemtic Name: 5-(6-aminopurin-9-yl)-4-azido-2-(hydroxymethyl)oxolan-3-ol; phosphoric acid Openeye Name: 5-(6-aminopurin-9-yl)-4-azido-2-(hydroxymethyl)tetrahydrofuran-3-ol; phosphoric acid CAS Name: 5-(6-aminopurin-9-yl)-4-azido-2-(hydroxymethyl)-3-oxolanol; phosphoric acid IUPAC Name: 5-(6-aminopurin-9-yl)-4-azido-2-(hydroxymethyl)oxolan-3-ol; phosphoric acid Traditional Name: 5-adenin-9-yl-4-azido-2-methylol-tetrahydrofuran-3-ol; phosphoric acid Formula: C10H21N8O15P3 MolecularWeight: 586.239623

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)N=[N+]=[N-].OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)N=[N+]=[N-].OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C10H12N8O3.3H3O4P/c11-8-6-9(14-2-13-8)18(3-15-6)10-5(16-17-12)7(20)4(1-19)21-10;3*1-5(2,3)4/h2-5,7,10,19-20H,1H2,(H2,11,13,14);3*(H3,1,2,3,4)