N-Ethyl-L-glutamin

theanine · N5-Ethyl-L-glutamine · N-Ethyl-L-glutamine · Theanin · SUNTHEANINE · L-Theanine 3081-61-6 · N-GAMMA-ETHYL-L-GLUTAMINE · THEA

https://huagongshe.com/de/chemical/439378

Identifikatoren & physikalische Daten

CAS No.	3081-61-6
Summenformel	C7H14N2O3
Durchschnittliche Molmasse	174,2 g/mol
Monoisotopische Masse	174,10044231 g/mol
SMILES	CCNC(=O)CC[C@H](N)C(=O)O
InChIKey	DATAGRPVKZEWHA-YFKPBYRVSA-N
PubChem CID	439378
ChEMBL	CHEMBL3039113
ChEBI	CHEBI:17394
EC No.	221-379-0
DTXSID	DTXSID80184817
Lokaler Name	N-Ethyl-L-glutamin

Chemische & physikalische Eigenschaften

XLogP	-3,6
Polarare Oberfläche (TPSA)	92,4
H-Brücken-Donoren	3
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	5
Schwere Atome	12
Formalladung	0
Komplexität	170
Arzneimittel	Pharmaceuticals -> Listed in ZINC15
pH	pH of 5-6 (1% solution)
Geruch	None (no odor)
Geschmack	Astringent, sweetSlightly sweet
Color/Form	White crystals from ethanol + water
Löslichkeit	Soluble in 2.6 parts water at 0 °Csoluble in 1.8 parts water at 100 °CInsoluble in ethanol and etherSoluble in Water (up to 20 mg/ml).almost transparency
Human Drugs	Breast FeedingLactationMilk, HumanComplementary Therapies
Siedepunkt	214-216 °C430.2±40.0 °C(Predicted)
Schmelzpunkt	174.20217 - 218 °C207°C
Polymerization	Product is considered stable and hazardous polymerization will not occur.
Physical Description	Solid
Stability/Shelf Life	Product is considered stable and hazardous polymerization will not occur.
Dichte	1.171±0.06 g/cm3(Predicted)
Brechungsindex	8 ° (C=5, H2O)
Lagerbedingungen	2-8°C
pKa (Säurekonstante)	2.24±0.10(Predicted)
Aggregatzustand	powder
Farbe	White
Geruch	Odorless
Henry-Konstante	1.1×1010 mol/(m3Pa) at 25℃, HSDB (2015)
Stabilität	Stable for 2 years from date of purchase as supplied. Solutions in distilled water may be stored at -20° for up to 2 months.
Hauptanwendungen	cell analysis
Kosmetik-Inhaltsstoffe Funktionen	SKIN CONDITIONING - EMOLLIENTHUMECTANTSKIN CONDITIONING
InChI	InChI=1S/C7H14N2O3/c1-2-9-5(7(11)12)3-4-6(8)10/h5,9H,2-4H2,1H3,(H2,8,10)(H,11,12)/t5-/m0/s1
InChIKey	DATAGRPVKZEWHA-YFKPBYRVSA-N
SMILES	C(O)(=O)[C@H](CCC(N)=O)NCC
LogP (Verteilungskoeffizient)	-0.661 (est)
CAS Datenbank	3081-61-6(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 0.5% (1 of 206) of reports.WarningH317 (99.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 206 reports by companies from 3 notifications to the ECHA C&L Inventory.
Other Hazardous Reactions	Persons with impaired respiratory function, airway diseases and conditions such as emphysema or chronic bronchitis, may incur further disability if excessive concentrations of particulate are inhaled.
Toxic Combustion Products	Combustion products include: carbon monoxide (CO), carbon dioxide (CO2), nitrogen oxides (NOx), other pyrolysis products typical of burning organic material. May emit corrosive fumes.
Hazard Classes and Categories	Skin Sens. 1 (99.5%)
Hazardous Reactivities and Incompatibilities	Avoid contamination with oxidizing agents i.e. nitrates, oxidizing acids,chlorine bleaches, pool chlorine etc. as ignition may result.
Firefighting Hazards	Combustible solid which burns but propagates flame with difficulty. Avoid generating dust, particularly clouds of dust in a confined or unventilated space as dusts may form an explosive mixture with air, and any source of ignition, i.e. flame or spark, will cause fire or explosion. Dust clouds generated by the fine grinding of the solid are a particular hazardaccumulations of fine dust may burn rapidly and fiercely if ignited.
Brandbekämpfungsverfahren	Wear breathing apparatus plus protective gloves.Water spray or fog. Foam./If swallowed/, immediately give a glass of water. " First aid is not generally required. If in doubt, contact a poisons information center or a doctor. If this product comes in contact with eyes: Wash out immediately with water. If irritation continues, seek medical attention. If skin contact occurs: Immediately remove all contaminated clothing, including footwear. Flush skin and hair with running water (and soap if available). If dust is inhaled, remove from contaminated area. Encourage patient to blow nose to ensure clear passage of breathing. If irritation or discomfort persists seek medical attention.

Anwendungen & Verwendung

Beschreibung

L-Theanine is the major amino acid found in Camellia sinensis, the source of green tea. It is an analog of the excitatory neurotransmitter, glutamate, and thusly, binds to glutamate receptors. L-Theanine can antagonize various glutamate receptor subtypes as well as inhibit glutamine and glutamate transporters, which has been shown to be neuroprotective in animal models of focal cerebral ischemia. Further, L-theanine is reported to increase brain levels of dopamine, serotonin, GABA, nerve growth factor, and brain-derived neurotrophic factor.