[3-oxidanyl-5-[6-[(2-oxidanyl-1-phenyl-ethyl)amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [3-oxidanyl-5-[6-[(2-oxidanyl-1-phenyl-ethyl)amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [3-hydroxy-5-[6-[(2-hydroxy-1-phenyl-ethyl)amino]purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [3-hydroxy-5-[6-[(2-hydroxy-1-phenylethyl)amino]-9-purinyl]-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [3-hydroxy-5-[6-[(2-hydroxy-1-phenylethyl)amino]purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [3-hydroxy-5-[6-[(2-hydroxy-1-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=C3NC(CO)C4=CC=CC=C4)COP(=O)(O)O)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2N=CN=C3NC(CO)C4=CC=CC=C4)COP(=O)(O)O)O

InChI

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