(6-azanylpurin-5-yl) [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate

Systemtic Name: (6-azanylpurin-5-yl) [oxidanyl(phosphonooxy)phosphoryl] hydrogen phosphate Openeye Name: (6-aminopurin-5-yl) [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate CAS Name: (6-amino-5-purinyl) [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate IUPAC Name: (6-aminopurin-5-yl) [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate Traditional Name: (6-aminopurin-5-yl) [hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate Formula: C5H8N5O10P3 MolecularWeight: 391.065803

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=NC=NC2(C(=N1)N)OP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

C1=NC2=NC=NC2(C(=N1)N)OP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C5H8N5O10P3/c6-3-5(4(8-1-7-3)9-2-10-5)18-22(14,15)20-23(16,17)19-21(11,12)13/h1-2H,(H,14,15)(H,16,17)(H2,11,12,13)(H2,6,7,8,9,10)