[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methyl phenyl hydrogen phosphate

Systemtic Name: [(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methyl phenyl hydrogen phosphate Openeye Name: [(2S,5R)-5-(6-aminopurin-9-yl)tetrahydrofuran-2-yl]methyl phenyl hydrogen phosphate CAS Name: [(2S,5R)-5-(6-aminopurin-9-yl)-2-oxolanyl]methyl phenyl hydrogen phosphate IUPAC Name: [(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methyl phenyl hydrogen phosphate Traditional Name: [(2S,5R)-5-adenin-9-yltetrahydrofuran-2-yl]methyl phenyl hydrogen phosphate Formula: C16H18N5O5P MolecularWeight: 391.318381

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1COP(=O)(O)OC2=CC=CC=C2)N3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1C[C@@H](O[C@@H]1COP(=O)(O)OC2=CC=CC=C2)N3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C16H18N5O5P/c17-15-14-16(19-9-18-15)21(10-20-14)13-7-6-12(25-13)8-24-27(22,23)26-11-4-2-1-3-5-11/h1-5,9-10,12-13H,6-8H2,(H,22,23)(H2,17,18,19)/t12-,13+/m0/s1