[(4-methanoyl-6-methyl-5-oxidanyl-pyridin-3-yl)methoxy-oxidanyl-phosphoryl]oxy (4-methanoyl-6-methyl-pyridin-3-yl)methyl hydrogen phosphate

Systemtic Name: [(4-methanoyl-6-methyl-5-oxidanyl-pyridin-3-yl)methoxy-oxidanyl-phosphoryl]oxy (4-methanoyl-6-methyl-pyridin-3-yl)methyl hydrogen phosphate Openeye Name: [(4-formyl-5-hydroxy-6-methyl-3-pyridyl)methoxy-hydroxy-phosphoryl]oxy (4-formyl-6-methyl-3-pyridyl)methyl hydrogen phosphate CAS Name: [(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy-hydroxyphosphoryl]oxy (4-formyl-6-methyl-3-pyridinyl)methyl hydrogen phosphate IUPAC Name: [(4-formyl-5-hydroxy-6-methylpyridin-3-yl)methoxy-hydroxyphosphoryl]oxy (4-formyl-6-methylpyridin-3-yl)methyl hydrogen phosphate Traditional Name: [(4-formyl-5-hydroxy-6-methyl-3-pyridyl)methoxy-hydroxy-phosphoryl]oxy (4-formyl-6-methyl-3-pyridyl)methyl hydrogen phosphate Formula: C16H18N2O11P2 MolecularWeight: 476.268442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1)C=O)COP(=O)(O)OOP(=O)(O)OCC2=CN=C(C(=C2C=O)O)C

Isomeric SMILES

CC1=NC=C(C(=C1)C=O)COP(=O)(O)OOP(=O)(O)OCC2=CN=C(C(=C2C=O)O)C

InChI

InChI=1S/C16H18N2O11P2/c1-10-3-12(6-19)13(4-17-10)8-26-30(22,23)28-29-31(24,25)27-9-14-5-18-11(2)16(21)15(14)7-20/h3-7,21H,8-9H2,1-2H3,(H,22,23)(H,24,25)