[(2R)-2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]butan-2-yl]phosphonic acid

Systemtic Name: [(2R)-2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]butan-2-yl]phosphonic acid Openeye Name: [(1R)-1-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]-1-methyl-propyl]phosphonic acid CAS Name: [(2R)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]butan-2-yl]phosphonic acid IUPAC Name: [(2R)-2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]butan-2-yl]phosphonic acid Traditional Name: [(1R)-1-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridyl]methylamino]-1-methyl-propyl]phosphonic acid Formula: C12H22N2O8P2 MolecularWeight: 384.259202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(NCC1=C(C(=NC=C1COP(=O)(O)O)C)O)P(=O)(O)O

Isomeric SMILES

CC[C@](C)(NCC1=C(C(=NC=C1COP(=O)(O)O)C)O)P(=O)(O)O

InChI

InChI=1S/C12H22N2O8P2/c1-4-12(3,23(16,17)18)14-6-10-9(7-22-24(19,20)21)5-13-8(2)11(10)15/h5,14-15H,4,6-7H2,1-3H3,(H2,16,17,18)(H2,19,20,21)/t12-/m1/s1