[(2R,3S,5R)-5-(2-azanyl-6-ethoxy-8-tritio-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [(2R,3S,5R)-5-(2-azanyl-6-ethoxy-8-tritio-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [(2R,3S,5R)-5-(2-amino-6-ethoxy-8-tritio-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [(2R,3S,5R)-5-(2-amino-6-ethoxy-8-tritio-9-purinyl)-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [(2R,3S,5R)-5-(2-amino-6-ethoxy-8-tritiopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [(2R,3S,5R)-5-(2-amino-6-ethoxy-8-tritio-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C12H18N5O7P MolecularWeight: 377.28249

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC2=C1N=CN2C3CC(C(O3)COP(=O)(O)O)O)N

Isomeric SMILES

[3H]C1=NC2=C(N1[C@H]3C[C@@H]([C@H](O3)COP(=O)(O)O)O)N=C(N=C2OCC)N

InChI

InChI=1S/C12H18N5O7P/c1-2-22-11-9-10(15-12(13)16-11)17(5-14-9)8-3-6(18)7(24-8)4-23-25(19,20)21/h5-8,18H,2-4H2,1H3,(H2,13,15,16)(H2,19,20,21)/t6-,7+,8+/m0/s1/i5T