disodium 9-[(2R,4S)-4-(phosphonatomethoxy)oxolan-2-yl]purin-6-amine

Systemtic Name: disodium 9-[(2R,4S)-4-(phosphonatomethoxy)oxolan-2-yl]purin-6-amine Openeye Name: disodium 9-[(2R,4S)-4-(phosphonatomethoxy)tetrahydrofuran-2-yl]purin-6-amine CAS Name: disodium 9-[(2R,4S)-4-(phosphonatomethoxy)-2-oxolanyl]-6-purinamine IUPAC Name: disodium 9-[(2R,4S)-4-(phosphonatomethoxy)oxolan-2-yl]purin-6-amine Traditional Name: disodium [9-[(2R,4S)-4-(phosphonatomethoxy)tetrahydrofuran-2-yl]purin-6-yl]amine Formula: C10H12N5Na2O5P MolecularWeight: 359.186081

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC1N2C=NC3=C2N=CN=C3N)OCP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

C1[C@@H](CO[C@H]1N2C=NC3=C2N=CN=C3N)OCP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C10H14N5O5P.2Na/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-6(2-19-7)20-5-21(16,17)18;;/h3-4,6-7H,1-2,5H2,(H2,11,12,13)(H2,16,17,18);;/q;2*+1/p-2/t6-,7+;;/m0../s1