HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Phospho-L-tyrosine
PHOSPHOTYROSINE · O-Phosphotyrosine · p-Tyr · H-TYR(P)-OH · Phospho-Tyr · H-Tyr(PO3)-OH · H-TYR(H2PO3)-OH · H-TYR(PO3H2)-OH
Identifikatoren & physikalische Daten
| CAS No. | 21820-51-9 |
|---|---|
| Summenformel | C9H12NO6P |
| Durchschnittliche Molmasse | 261,17 g/mol |
| Monoisotopische Masse | 261,04022373 g/mol |
| SMILES | N[C@@H](Cc1ccc(OP(=O)(O)O)cc1)C(=O)O |
| InChIKey | DCWXELXMIBXGTH-QMMMGPOBSA-N |
| PubChem CID | 30819 |
| ChEMBL | CHEMBL286939 |
| ChEBI | CHEBI:37788 |
| EC No. | 891-585-9 |
| DTXSID | DTXSID00176234 |
Chemische & physikalische Eigenschaften
| XLogP | -2,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 130 |
| H-Brücken-Donoren | 4 |
| H-Brücken-Akzeptoren | 7 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 17 |
| Formalladung | 0 |
| Komplexität | 309 |
| Stoffklassen | Biological Agents -> Amino Acids and Derivatives |
| Arzneimittel | Pharmaceuticals -> Listed in ZINC15 |
| Physical Description | White solid[Sigma-Aldrich MSDS] |
| Collision Cross Section | 149.33 Ų [M+Na-2H]- [CCS Type: DTMethod: single field calibrated with Agilent tune mix (Agilent)] |
| Schmelzpunkt | 226-227°C |
| Siedepunkt | 521.7±60.0 °C(Predicted) |
| Dichte | 1.591±0.06 g/cm3(Predicted) |
| Lagerbedingungen | Sealed in dry,Store in freezer, under -20°C |
| Löslichkeit | Aqueous Acid (Slightly), Water (Slightly, Sonicated) |
| Aggregatzustand | Solid |
| pKa (Säurekonstante) | 1.24±0.30(Predicted) |
| Farbe | White to Off-White |
| BRN | 3150815 |
| InChI | 1S/C9H12NO6P/c10-8(9(11)12)5-6-1-3-7(4-2-6)16-17(13,14)15/h1-4,8H,5,10H2,(H,11,12)(H2,13,14,15)/t8-/m0/s1 |
| InChIKey | DCWXELXMIBXGTH-QMMMGPOBSA-N |
| SMILES | N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(O)=O |
| CAS Datenbank | 21820-51-9(CAS DataBase Reference) |
Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.Not ClassifiedAggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatorische Informationen | Status: Active Update: 04-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34754 |
| Gefahrenübersicht | May cause irritation[Sigma-Aldrich MSDS] |
| Hazard Classes and Categories | Not Classified |
| F | 10-21 |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29225090 |
| R-Sätze (R) | 21/22 |
| Gefahrensymbole | Xn |
| Sicherheitshinweise (S) | 36/37 |
| Lagerklasse | 11 - Combustible Solids |
Anwendungen & Verwendung
Verwenden
O-Phospho-L-tyrosine is used in the study of tyrosine-phosphorylation, which has been linked to the malignant transformation of cells by various RNA tumor viruses. Plays a role in signal transduction.