Melevodopa hydrochloride
Grundinformationen
- CAS
1421-65-4- Standard-SMILES
COC(=O)[C@@H](N)Cc1ccc(O)c(O)c1.Cl- InChIKey
WFGNJLMSYIJWII-FJXQXJEOSA-N- Summenformel
- C10H14ClNO4
- Durchschnittliche Molmasse
- 247,67 g/mol
- Monoisotopische Masse
- 247,06113561
Überblick
Melevodopa hydrochloride is an organic molecular entity.
Namen und Bezeichner
- Bevorzugter Name
- Melevodopa hydrochloride
- IUPAC
- methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate;hydrochloride
- Englischer Name
- L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride
- Summenformel
- C10H14ClNO4
- Molmasse
- 247.68
Namen und Synonyme
(S)-Methyl 2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochlorideMelevodopa hydrochlorideL-Dopa methyl ester hydrochlorideL-Tyrosine, 3-hydroxy-, methyl ester, hydrochloride (1:1)levodopa methyl ester hydrochlorideL-Dopa Me ester hydrochlorideL-Tyrosine, 3-hydroxy-, methyl ester, hydrochlorideJFU1A8866VST 41769ST-41769Alanine, 3-(3,4-dihydroxyphenyl)-, methyl ester, hydrochloride, l-3,4-Dihydroxyphenyl-l-alanine methyl ester hydrochloride
Weitere Namen anzeigen
Melevodopamethyldopa hydrochloride3,4-Dihydroxy-L-phenylalanine Methyl Ester HydrochlorideNsc295453Levodopa Impurity 10LevoMet HydrochlorideDopamine, methyl esterL-DOPA Methyl Ester HClH-TYR(3-HYDROXY)-OME HCL
Methyl l-3-(3,4-dihydroxyphenyl)alaninate hydrochlorideAlanine, 3-(3,4-dihydroxyphenyl)-, methyl ester, hydrochlorideNSC 295453NSC-295453RefChem:810882630-429-41421-65-4L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride
Datenbank-Bezeichner
- CAS
1421-65-4- PubChem CID
- 10131132
- DTXSID
DTXSID4045763- ChEMBL
CHEMBL1255756- ChEBI
CHEBI:232320- UNII
- JFU1A8866V
- EC Number
- 630-429-4
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 92,8 Ų
- H-Brücken-Donoren
- 4
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 16
- Formalladung
- 0
- Komplexität
- 221
Physikochemische Eigenschaften
- Schmelzpunkt
- 174 · 174-175℃
- storage temp.
- -20 °C · -20°C
- Löslichkeit
- DMSO (Slightly), Methanol (Slightly)
- Aggregatzustand
- solid
- Farbe
- white
- InChI
- InChI=1/C10H13NO4.ClH/c1-15-10(14)7(11)4-6-2-3-8(12)9(13)5-6;/h2-3,5,7,12-13H,4,11H2,1H3;1H/t7-;/s3
- InChIKey
- WFGNJLMSYIJWII-WMASNCOMNA-N
- SMILES
- C1(=CC=C(O)C(O)=C1)C[C@H](N)C(=O)OC.Cl |&1:9,r|
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 25% (1 of 4) of reports.
Warning
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Sicherheitsdaten
- wgk
- 3
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationAgents used in the treatment of Parkinson's disease. The most commonly used drugs act on the dopaminergic system in the striatum and basal ganglia or are centrally acting muscarinic antagonists.
Anwendungen
BeschreibungL-DOPA (Item No. 13248) is a metabolic precursor of dopamine that is capable of crossing the blood brain barrier to act as a dopamine D1 receptor agonist. It is produced from L-tyrosine by trysosine hydroxylase. In the brain, L-DOPA is converted to dopamine by the enzyme aromatic L-amino acid decarboxylase. It is conventionally used to increase dopamine concentrations in the brain as a treatment for Parkinson’s disease and stroke recovery. L-DOPA methyl ester is a neutral derivative of L-DOPA formulated for increased solubility compared to the parent compound.
VerwendenL-3,4-Dihydroxyphenylalanine methyl ester hydrochloride has been used:in treating 6-hydroxydopamine induced lesions mice serotonin neuronsin tyrosinase activity in B16F10 skin melanoma cellsto test its neuroprotective effect in mesencephalic neurons
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Zugehörige Reaktionen
1
Notizen zur Verbindung
Wird geladen…