[3-oxidanyl-5-[6-[(2-oxidanyl-2-phenyl-ethyl)amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [3-oxidanyl-5-[6-[(2-oxidanyl-2-phenyl-ethyl)amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [3-hydroxy-5-[6-[(2-hydroxy-2-phenyl-ethyl)amino]purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [3-hydroxy-5-[6-[(2-hydroxy-2-phenylethyl)amino]-9-purinyl]-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [3-hydroxy-5-[6-[(2-hydroxy-2-phenylethyl)amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [3-hydroxy-5-[6-[(2-hydroxy-2-phenyl-ethyl)amino]purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C18H22N5O7P MolecularWeight: 451.370341

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3NCC(C4=CC=CC=C4)O)COP(=O)(O)O)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3NCC(C4=CC=CC=C4)O)COP(=O)(O)O)O

InChI

InChI=1S/C18H22N5O7P/c24-12-6-15(30-14(12)8-29-31(26,27)28)23-10-22-16-17(20-9-21-18(16)23)19-7-13(25)11-4-2-1-3-5-11/h1-5,9-10,12-15,24-25H,6-8H2,(H,19,20,21)(H2,26,27,28)