3-Hydroxy-N-methyl-L-tyrosine
Grundinformationen
- CAS
70152-53-3- Standard-SMILES
CN[C@@H](Cc1ccc(O)c(O)c1)C(=O)O- InChIKey
QZIWDCLHLOADPK-ZETCQYMHSA-N- Summenformel
- C10H13NO4
- Durchschnittliche Molmasse
- 211,21 g/mol
- Monoisotopische Masse
- 211,0844579
Überblick
N-methyl-L-dopa is the L-enantiomer of N-methyldopa. It is functionally related to a L-dopa. It is an enantiomer of a N-methyl-D-dopa. It is a tautomer of a N-methyl-L-dopa zwitterion.
Namen und Bezeichner
- Bevorzugter Name
- 3-Hydroxy-N-methyl-L-tyrosine
- IUPAC
- (2S)-3-(3,4-dihydroxyphenyl)-2-(methylamino)propanoic acid
- Englischer Name
- N-Methyldopa
- Summenformel
- C10H13NO4
- Molmasse
- 211.21
Namen und Synonyme
N-Methyl-L-DOPA3-Hydroxy-N-methyl-L-tyrosine(2S)-3-(3,4-dihydroxyphenyl)-2-(methylamino)propanoic acidCHEBI:167646DTXSID20635212N-methyl-3,4-dihydroxy-L-phenylalaninebeta-(3,4-dihydroxyphenyl)-N-methyl-L-alanineRefChem:279940DTXCID0058596370152-53-3(-)methyl-dopa3-Hydroxy-N-methyl-L-tyrosine; 3-(3,4-Dihydroxyphenyl)-N-methylalanine; ss-(3,4-Dihydroxyphenyl)-N-methylalanine; N-Methyldopa;
Weitere Namen anzeigen
N-MethyldopaL-Tyrosine, 3-hydroxy-N-methyl-β-(3,4-Dihydroxyphenyl)-N-Methylalanine3-(3,4-Dihydroxyphenyl)-N-Methylalanine
SCHEMBL2283369QZIWDCLHLOADPK-ZETCQYMHSA-NDB-231540
Datenbank-Bezeichner
- CAS
70152-53-3- PubChem CID
- 23620856
- DTXSID
DTXSID20635212- ChEBI
CHEBI:167646- Nikkaji
- J1.297.759J
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -2,2
- Polarare Oberfläche (TPSA)
- 89,8 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 221
Physikochemische Eigenschaften
- Melting point
- 261 °C · >261°C (dec.)
- Boiling point
- 436.3 · 436.3±45.0 °C(Predicted)
- Density
- 1.354 · 1.354±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Aqueous Acid (Slightly), Aqueous Base (Slightly)
- pka
- 2.25 · 2.25±0.26(Predicted)
- form
- Solid
- color
- White to Off-White
Chemie und Industrie
Anwendungen
UsesN-Methyl-L-DOPA is a methylated L-DOPA that can act as a potential alternative substrate or competitive inhibitor of tyrosinase.
Anbieter8 Anbieter
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Ergänzende Hinweise
DefinitionChEBI: N-methyl-L-dopa is the L-enantiomer of N-methyldopa. It is functionally related to a L-dopa. It is an enantiomer of a N-methyl-D-dopa. It is a tautomer of a N-methyl-L-dopa zwitterion.
Zugehörige Reaktionen
4
Notizen zur Verbindung
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