3-hydroxy-4-methyl-L-kynurenine zwitterion (CHEBI:141609)

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CHEBI:141609 - 3-hydroxy-4-methyl-L-kynurenine zwitterion

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ChEBI ID	CHEBI:141609
ChEBI Name	3-hydroxy-4-methyl-L-kynurenine zwitterion
Stars
Definition	Zwitterionic form of 3-hydroxy-4-methyl-L-kynurenine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3
Submitter	Anne Morgat
Downloads	Molfile

Formula	C11H14N2O4
Net Charge	0
Average Mass	238.243
Monoisotopic Mass	238.09536
SMILES	Cc1ccc(C(=O)C[C@H]([NH3+])C(=O)[O-])c(N)c1O
InChI	InChI=1S/C11H14N2O4/c1-5-2-3-6(9(13)10(5)15)8(14)4-7(12)11(16)17/h2-3,7,15H,4,12-13H2,1H3,(H,16,17)/t7-/m0/s1
InChIKey	BHPWCYYINLFUDE-ZETCQYMHSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-hydroxy-4-methyl-L-kynurenine zwitterion (CHEBI:141609) has functional parent L-kynurenine zwitterion (CHEBI:57959)
	3-hydroxy-4-methyl-L-kynurenine zwitterion (CHEBI:141609) has functional parent 3-hydroxy-L-kynurenine zwitterion (CHEBI:58125)
	3-hydroxy-4-methyl-L-kynurenine zwitterion (CHEBI:141609) is a amino-acid zwitterion (CHEBI:35238)
	3-hydroxy-4-methyl-L-kynurenine zwitterion (CHEBI:141609) is enantiomer of 3-hydroxy-4-methyl-D-kynurenine zwitterion (CHEBI:141611)
Incoming Relation(s)
Incoming Relation(s)	3-hydroxy-4-methyl-D-kynurenine zwitterion (CHEBI:141611) is enantiomer of 3-hydroxy-4-methyl-L-kynurenine zwitterion (CHEBI:141609)

Synonym	Source
L-3H4MK	SUBMITTER

UniProt Name	Source
3-hydroxy-4-methyl-L-kynurenine	UniProt

Manual Xrefs	Databases
CPD-18908	MetaCyc

Citations