[4-(aminomethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methylsulfanylphosphonic acid

Systemtic Name: [4-(aminomethyl)-6-methyl-5-oxidanyl-pyridin-3-yl]methylsulfanylphosphonic acid Openeye Name: [4-(aminomethyl)-5-hydroxy-6-methyl-3-pyridyl]methylsulfanylphosphonic acid CAS Name: [[4-(aminomethyl)-5-hydroxy-6-methyl-3-pyridinyl]methylthio]phosphonic acid IUPAC Name: [4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methylsulfanylphosphonic acid Traditional Name: [[4-(aminomethyl)-5-hydroxy-6-methyl-3-pyridyl]methylthio]phosphonic acid Formula: C8H13N2O4PS MolecularWeight: 264.238581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CN)CSP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CN)CSP(=O)(O)O

InChI

InChI=1S/C8H13N2O4PS/c1-5-8(11)7(2-9)6(3-10-5)4-16-15(12,13)14/h3,11H,2,4,9H2,1H3,(H2,12,13,14)