N-Acetylglutaminsure

N-acetyl-L-glutamic acid

HCID 70914

Grundinformationen

CAS
1188-37-0
Standard-SMILES
CC(=O)N[C@@H](CCC(=O)O)C(=O)O
InChIKey
RFMMMVDNIPUKGG-YFKPBYRVSA-N
Summenformel
C7H11NO5
Durchschnittliche Molmasse
189,17 g/mol
Monoisotopische Masse
189,06372245

Namen und Bezeichner

Bevorzugter Name
N-acetyl-L-glutamic acid
IUPAC
(2S)-2-acetamidopentanedioic acid
Lokaler Name
N-Acetylglutaminsure
Englischer Name
N-Acetyl-L-glutamic acid
Summenformel
C7H11NO5
Molmasse
189.17

Namen und Synonyme

N-Acetyl-L-glutamic acid1188-37-0acetylglutamic acidAcetyl-L-glutamic acidN-acetyl-L-glutamateAcetyl glutamic acid(2S)-2-acetamidopentanedioic acidAc-Glu-OHL-N-Acetylglutamic acidL-Glutamic acid, N-acetyl-Glutamic acid, N-acetyl-, L-N-Ac-Glu-OH
Weitere Namen anzeigen
N-Acetylglutamic acidn-acetylglutamateNAcGluN-AC-L-GLUAc-L-Glu-OHl-glutamicaciN-Ac-L-Glu-OH
DTXSID3046534MA61H539YZCHEBI:17533N-acetyl-L-glutaminic acidCHEMBL1234751FEMA NO. 4752N-ACETYL-S-GLUTAMIC ACID(2S)-2-(acetylamino)pentanedioic acid

Datenbank-Bezeichner

CAS
1188-37-0、5817-08-3
PubChem CID
70914
DTXSID
DTXSID3046534
ChEMBL
CHEMBL1234751
ChEBI
CHEBI:17533
UNII
MA61H539YZ
Nikkaji
J37.497K

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-1,8
Polarare Oberfläche (TPSA)
104 Ų
H-Brücken-Donoren
3
H-Brücken-Akzeptoren
5
Frei drehbare Bindungen
5
Schwere Atome
13

Experimentelle und physikochemische Eigenschaften

Solubility · 3 Einträge

52 mg/mL

Soluble

Sparingly soluble (in ethanol)

Melting Point · 2 Einträge

199

199 - 201 °C

Physical Description · 2 Einträge

Solid

White powder or white crystals; Savoury, cooked roasted

Collision Cross Section · 5 Einträge

141 Ų [M+Na-2H]- [CCS Type: DT; Method: single field calibrated with Agilent tune mix (Agilent)]

139.63 Ų [M-H]- [CCS Type: DT; Method: stepped-field];149.63 Ų [M+Na]+ [CCS Type: DT; Method: stepped-field];139.03 Ų [M+H]+ [CCS Type: DT; Method: stepped-field]

141.7 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

143.3 Ų [M+Na-2H]- [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)];142.4 Ų [M+Na]+ [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)];136.9 Ų [M-H]- [CCS Type: DT; Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

142.5 Ų [M+Na]+;143.5 Ų [M-2H+Na]-;137 Ų [M-H]-

Physikochemische Eigenschaften

Schmelzpunkt
194 · 194-196 °C(lit.)
Siedepunkt
324.41 °C · 324.41°C (rough estimate)
Dichte
1.4119 · 1.4119 (rough estimate)
FEMA
4752 · 4752 | N-ACETYL GLUTAMATE
Brechungsindex
-15 ° · -15 ° (C=1, H2O)
storage temp.
2 · 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 93.8% (15 of 16) of all reports.

Not Classified;Reported as not meeting GHS hazard criteria by 15 of 16 companies (only 6.2% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 16 reports by companies from 2 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 15 of 16 reports by companies.;There is 1 notification provided by 1 of 16 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Status: Active Update: 27-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26044;Status: Cease Manufacture Update: 24-03-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/16366

L-Glutamic acid, N-acetyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesNot Classified

Toxikologische Informationen

Toxicity Summary · 2 Einträge

The panel concluded that the 115 amino acid alkyl amides listed below are safe in the present practices of use and concentration in cosmetics, when formulated to be non-irritating...Acetyl Glutamic Acid

Safe for use in cosmetics, with qualifications

Regulatorische Informationen

Regulatory Information · 2 Einträge

Status: Active Update: 27-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26044;Status: Cease Manufacture Update: 24-03-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/16366

L-Glutamic acid, N-acetyl-: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

wgk
2
tsca
TSCA listed
hs_code
29241900
RTECS-Nr.
LZ9725000
safety_code
24/25
Speicherklasse
11 - Combustible Solids

Chemie und Industrie

Pharmakologische Informationen

Tissue LocationsLiver;Placenta
Cellular LocationsMitochondria

Verwendung und Herstellung

UsesCIR ingredient: Acetyl Glutamic Acid
Use Classification · 3 Einträge

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Cosmetics -> Skin conditioning

General Manufacturing Information · 2 Einträge

L-Glutamic acid, N-acetyl-: ACTIVE

Glutamic acid, N-acetyl-: INACTIVE

Anwendungen

VerwendenN-Acetyl-L-glutamic Acid is the N-Acetyl analogue of the non-essential amino acid, L-glutamic acid (G596960). N-Acetyl-L-glutamic Acid activates carbamoyl phosphate synthetase in the urea cycle.

Anbieter100 Anbieter

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南京一化生物科技有限公司13429882898; 13429882898
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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