[5-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-4-azido-oxolan-2-yl]phosphonic acid

Systemtic Name: [5-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-4-azido-oxolan-2-yl]phosphonic acid Openeye Name: [5-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-4-azido-tetrahydrofuran-2-yl]phosphonic acid CAS Name: [5-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-4-azido-2-oxolanyl]phosphonic acid IUPAC Name: [5-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-4-azidooxolan-2-yl]phosphonic acid Traditional Name: [5-[(2-amino-6-keto-3H-purin-9-yl)methyl]-4-azido-tetrahydrofuran-2-yl]phosphonic acid Formula: C10H13N8O5P MolecularWeight: 356.234581

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1P(=O)(O)O)CN2C=NC3=C2NC(=NC3=O)N)N=[N+]=[N-]

Isomeric SMILES

C1C(C(OC1P(=O)(O)O)CN2C=NC3=C2NC(=NC3=O)N)N=[N+]=[N-]

InChI

InChI=1S/C10H13N8O5P/c11-10-14-8-7(9(19)15-10)13-3-18(8)2-5-4(16-17-12)1-6(23-5)24(20,21)22/h3-6H,1-2H2,(H2,20,21,22)(H3,11,14,15,19)