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CHEBI:194020 - (6S)-3,3-dimethyl-5,6-dihydro-4H-pyridine-2,6-dicarboxylate

ChEBI IDCHEBI:194020
ChEBI Name(6S)-3,3-dimethyl-5,6-dihydro-4H-pyridine-2,6-dicarboxylate
Stars
ASCII Name(6S)-3,3-dimethyl-5,6-dihydro-4H-pyridine-2,6-dicarboxylate
DefinitionMajor microspecies at pH 7.3.
Last Modified21 October 2022
SubmitterAnne Morgat
DownloadsMolfile
FormulaC9H11NO4
Net Charge-2
Average Mass197.190
Monoisotopic Mass197.06990
SMILESCC1(C)CC[C@@H](C(=O)[O-])N=C1C(=O)[O-]
InChIInChI=1S/C9H13NO4/c1-9(2)4-3-5(7(11)12)10-6(9)8(13)14/h5H,3-4H2,1-2H3,(H,11,12)(H,13,14)/p-2/t5-/m0/s1
InChIKeyQFZUAQLFOODZQP-YFKPBYRVSA-L
ChEBI Ontology
Outgoing Relation(s)
(6S)-3,3-dimethyl-5,6-dihydro-4H-pyridine-2,6-dicarboxylate (CHEBI:194020) has functional parent 2,3,4,5-tetrahydrodipicolinate(2−) (CHEBI:11408)
(6S)-3,3-dimethyl-5,6-dihydro-4H-pyridine-2,6-dicarboxylate (CHEBI:194020) is a tetrahydropyridine (CHEBI:26921)
Synonym  Source
(2S)-5,5-dimethyl-2,3,4,5-tetrahydropyridine-2,6-dicarboxylateSUBMITTER
UniProt Name  Source
(2S)-5,5-dimethyl-2,3,4,5-tetrahydropyridine-2,6-dicarboxylateUniProt
Citations