disodium 2-[(2R,4S,5R,6R)-5-acetamido-2-[[ethoxy(oxidanidyl)phosphoryl]oxymethyl]-4-oxidanyl-6-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]oxan-2-yl]ethyl-[[(2R,3S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]phosphinate

Systemtic Name: disodium 2-[(2R,4S,5R,6R)-5-acetamido-2-[[ethoxy(oxidanidyl)phosphoryl]oxymethyl]-4-oxidanyl-6-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]oxan-2-yl]ethyl-[[(2R,3S,4R,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]phosphinate Openeye Name: disodium 2-[(2R,4S,5R,6R)-5-acetamido-2-[[ethoxy(oxido)phosphoryl]oxymethyl]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]tetrahydropyran-2-yl]ethyl-[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]phosphinate CAS Name: disodium 2-[(2R,4S,5R,6R)-5-acetamido-2-[[ethoxy(oxido)phosphoryl]oxymethyl]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-2-oxanyl]ethyl-[[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy]phosphinate IUPAC Name: disodium 2-[(2R,4S,5R,6R)-5-acetamido-2-[[ethoxy(oxido)phosphoryl]oxymethyl]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]ethyl-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphinate Traditional Name: disodium 2-[(2R,4S,5R,6R)-5-acetamido-2-[[ethoxy(oxido)phosphoryl]oxymethyl]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]tetrahydropyran-2-yl]ethyl-[[(2R,3S,4R,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]phosphinate Formula: C24H40N4Na2O17P2 MolecularWeight: 764.518062

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)([O-])OCC1(CC(C(C(O1)C(C(CO)O)O)NC(=O)C)O)CCP(=O)([O-])OCC2C(C(C(O2)N3C=CC(=NC3=O)N)O)O.[Na+].[Na+]

Isomeric SMILES

CCOP(=O)([O-])OC[C@@]1(C[C@@H]([C@H]([C@@H](O1)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)CCP(=O)([O-])OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=CC(=NC3=O)N)O)O.[Na+].[Na+]

InChI

InChI=1S/C24H42N4O17P2.2Na/c1-3-41-47(39,40)43-11-24(8-13(31)17(26-12(2)30)21(45-24)18(33)14(32)9-29)5-7-46(37,38)42-10-15-19(34)20(35)22(44-15)28-6-4-16(25)27-23(28)36;;/h4,6,13-15,17-22,29,31-35H,3,5,7-11H2,1-2H3,(H,26,30)(H,37,38)(H,39,40)(H2,25,27,36);;/q;2*+1/p-2/t13-,14+,15+,17+,18+,19+,20+,21+,22+,24-;;/m0../s1