N-methyl-L-dopa zwitterion (CHEBI:167490)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	N-methyl-L-dopa zwitterion

ChEBI ID	CHEBI:167490

ChEBI ASCII Name	N-methyl-L-dopa zwitterion

Stars	This entity has been manually annotated by a third party.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C10H13NO4

Net Charge

Average Mass

211.217

Monoisotopic Mass

211.08446

InChI

InChI=1S/C10H13NO4/c1-11-7(10(14)15)4-6-2-3-8(12)9(13)5-6/h2-3,5,7,11-13H,4H2,1H3,(H,14,15)/t7-/m0/s1

InChIKey

QZIWDCLHLOADPK-ZETCQYMHSA-N

SMILES

C[NH2+][C@@H](CC1=CC=C(O)C(O)=C1)C([O-])=O

ChEBI Ontology
Outgoing	N-methyl-L-dopa zwitterion (CHEBI:167490) has functional parent L-dopa zwitterion (CHEBI:57504) N-methyl-L-dopa zwitterion (CHEBI:167490) is a amino acid zwitterion (CHEBI:35238) N-methyl-L-dopa zwitterion (CHEBI:167490) is enantiomer of N-methyl-D-dopa zwitterion (CHEBI:167491) N-methyl-L-dopa zwitterion (CHEBI:167490) is tautomer of N-methyl-L-dopa (CHEBI:167646)

Incoming	N-methyl-D-dopa zwitterion (CHEBI:167491) is enantiomer of N-methyl-L-dopa zwitterion (CHEBI:167490) N-methyl-L-dopa (CHEBI:167646) is tautomer of N-methyl-L-dopa zwitterion (CHEBI:167490)

IUPAC Name

(2S)-3-(3,4-dihydroxyphenyl)-2-(methylazaniumyl)propanoate

Synonym	Source
N-methyl-L-dopa	UniProt

Last Modified

12 March 2021