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CHEBI:45168 - N-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)-2-METHYL-L-GLUTAMIC ACID

Default Structure
ChEBI IDCHEBI:45168
ChEBI NameN-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)-2-METHYL-L-GLUTAMIC ACID
Stars
DownloadsMolfile
FormulaC14H21N2O9P
Net Charge0
Average Mass392.301
Monoisotopic Mass392.09847
SMILES[H]OC(=O)C([H])([H])C([H])([H])[C@@](C(=O)O[H])(N([H])C([H])([H])c1c(O[H])c(C([H])([H])[H])nc([H])c1C([H])([H])OP(=O)(O[H])O[H])C([H])([H])[H]
InChIInChI=1S/C14H21N2O9P/c1-8-12(19)10(9(5-15-8)7-25-26(22,23)24)6-16-14(2,13(20)21)4-3-11(17)18/h5,16,19H,3-4,6-7H2,1-2H3,(H,17,18)(H,20,21)(H2,22,23,24)/t14-/m0/s1
InChIKeyCNIVMJHNGQZEAY-AWEZNQCLSA-N
ChEBI Ontology
Outgoing Relation(s)
N-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)-2-METHYL-L-GLUTAMIC ACID (CHEBI:45168) is a unclassifieds (CHEBI:27189)
Synonym  Source
N-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)-2-METHYL-L-GLUTAMIC ACIDPDBeChem
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