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

Systemtic Name: [(4-methanoyl-6-methyl-5-oxidanyl-pyridin-3-yl)methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [(4-formyl-5-hydroxy-6-methyl-3-pyridyl)methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: [(4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate IUPAC Name: [(4-formyl-5-hydroxy-6-methylpyridin-3-yl)methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [(4-formyl-5-hydroxy-6-methyl-3-pyridyl)methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C8H12NO12P3 MolecularWeight: 407.101663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)C=O)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)C=O)COP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C8H12NO12P3/c1-5-8(11)7(3-10)6(2-9-5)4-19-23(15,16)21-24(17,18)20-22(12,13)14/h2-3,11H,4H2,1H3,(H,15,16)(H,17,18)(H2,12,13,14)