sodium [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl] hexadecyl phosphate

Systemtic Name: sodium [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl] hexadecyl phosphate Openeye Name: sodium [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl] hexadecyl phosphate CAS Name: sodium [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxolanyl] hexadecyl phosphate IUPAC Name: sodium [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] hexadecyl phosphate Traditional Name: sodium [(2R,3S,5R)-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-3-yl] cetyl phosphate Formula: C47H64N2NaO10P MolecularWeight: 870.981991

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOP(=O)([O-])OC1CC(OC1COC(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)N5C=C(C(=O)NC5=O)C.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCOP(=O)([O-])O[C@H]1C[C@@H](O[C@@H]1COC(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)N5C=C(C(=O)NC5=O)C.[Na+]

InChI

InChI=1S/C47H65N2O10P.Na/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-32-57-60(52,53)59-42-33-44(49-34-36(2)45(50)48-46(49)51)58-43(42)35-56-47(37-22-19-18-20-23-37,38-24-28-40(54-3)29-25-38)39-26-30-41(55-4)31-27-39;/h18-20,22-31,34,42-44H,5-17,21,32-33,35H2,1-4H3,(H,52,53)(H,48,50,51);/q;+1/p-1/t42-,43+,44+;/m0./s1