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CHEBI:43322 - {1-[(3-HYDROXY-METHYL-5-PHOSPHONOOXY-METHYL-PYRIDIN-4-YLMETHYL)-AMINO]-ETHYL}-PHOSPHONIC ACID

Default Structure
ChEBI IDCHEBI:43322
ChEBI Name{1-[(3-HYDROXY-METHYL-5-PHOSPHONOOXY-METHYL-PYRIDIN-4-YLMETHYL)-AMINO]-ETHYL}-PHOSPHONIC ACID
Stars
DownloadsMolfile
FormulaC10H18N2O8P2
Net Charge0
Average Mass356.208
Monoisotopic Mass356.05384
SMILES[H]Oc1c(C([H])([H])[H])nc([H])c(C([H])([H])OP(=O)(O[H])O[H])c1C([H])([H])N([H])[C@@]([H])(C([H])([H])[H])P(=O)(O[H])O[H]
InChIInChI=1S/C10H18N2O8P2/c1-6-10(13)9(4-12-7(2)21(14,15)16)8(3-11-6)5-20-22(17,18)19/h3,7,12-13H,4-5H2,1-2H3,(H2,14,15,16)(H2,17,18,19)/t7-/m1/s1
InChIKeyWHDCJKAOZPBUAY-SSDOTTSWSA-N
ChEBI Ontology
Outgoing Relation(s)
{1-[(3-HYDROXY-METHYL-5-PHOSPHONOOXY-METHYL-PYRIDIN-4-YLMETHYL)-AMINO]-ETHYL}-PHOSPHONIC ACID (CHEBI:43322) is a unclassifieds (CHEBI:27189)
Synonyms  Source
{1-[(3-HYDROXY-METHYL-5-PHOSPHONOOXY-METHYL-PYRIDIN-4-YLMETHYL)-AMINO]-ETHYL}-PHOSPHONIC ACIDPDBeChem
{(1R)-1-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]ethyl}phosphonic acidPDBeChem
Manual XrefsDatabases
IN5PDBeChem