disodium [[2-[[(4-methanoyl-6-methyl-5-oxidanyl-pyridin-3-yl)methoxy-oxidanidyl-phosphoryl]oxyamino]cyclohexyl]amino] (4-methanoyl-6-methyl-5-oxidanyl-pyridin-3-yl)methyl phosphate

Systemtic Name: disodium [[2-[[(4-methanoyl-6-methyl-5-oxidanyl-pyridin-3-yl)methoxy-oxidanidyl-phosphoryl]oxyamino]cyclohexyl]amino] (4-methanoyl-6-methyl-5-oxidanyl-pyridin-3-yl)methyl phosphate Openeye Name: disodium [[2-[[(4-formyl-5-hydroxy-6-methyl-3-pyridyl)methoxy-oxido-phosphoryl]oxyamino]cyclohexyl]amino] (4-formyl-5-hydroxy-6-methyl-3-pyridyl)methyl phosphate CAS Name: disodium [[2-[[(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy-oxidophosphoryl]oxyamino]cyclohexyl]amino] (4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl phosphate IUPAC Name: disodium [[2-[[(4-formyl-5-hydroxy-6-methylpyridin-3-yl)methoxy-oxidophosphoryl]oxyamino]cyclohexyl]amino] (4-formyl-5-hydroxy-6-methylpyridin-3-yl)methyl phosphate Traditional Name: disodium [[2-[[(4-formyl-5-hydroxy-6-methyl-3-pyridyl)methoxy-oxido-phosphoryl]oxyamino]cyclohexyl]amino] (4-formyl-5-hydroxy-6-methyl-3-pyridyl)methyl phosphate Formula: C22H28N4Na2O12P2 MolecularWeight: 648.404382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)C=O)COP(=O)([O-])ONC2CCCCC2NOP(=O)([O-])OCC3=CN=C(C(=C3C=O)O)C.[Na+].[Na+]

Isomeric SMILES

CC1=NC=C(C(=C1O)C=O)COP(=O)([O-])ONC2CCCCC2NOP(=O)([O-])OCC3=CN=C(C(=C3C=O)O)C.[Na+].[Na+]

InChI

InChI=1S/C22H30N4O12P2.2Na/c1-13-21(29)17(9-27)15(7-23-13)11-35-39(31,32)37-25-19-5-3-4-6-20(19)26-38-40(33,34)36-12-16-8-24-14(2)22(30)18(16)10-28;;/h7-10,19-20,25-26,29-30H,3-6,11-12H2,1-2H3,(H,31,32)(H,33,34);;/q;2*+1/p-2