(E)-7-[(1R,4S,5S,6R)-6-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[2.2.1]heptan-5-yl]hept-5-enoic acid
Grundinformationen
- CAS
330796-58-2- Standard-SMILES
CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C/CCCC(=O)O)[C@H]2CO[C@@H]1C2- InChIKey
LQANGKSBLPMBTJ-JVCJGEKZSA-N- Summenformel
- C21H34O4
- Durchschnittliche Molmasse
- 350,5 g/mol
- Monoisotopische Masse
- 350,24570956
Namen und Bezeichner
- Bevorzugter Name
- (E)-7-[(1R,4S,5S,6R)-6-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[2.2.1]heptan-5-yl]hept-5-enoic acid
- IUPAC
- (E)-7-[(1R,4S,5S,6R)-6-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[2.2.1]heptan-5-yl]hept-5-enoic acid
- Englischer Name
- 5-TRANS U-46619
- Summenformel
- C21H34O4
- Molmasse
- 350.49
Namen und Synonyme
HY-130356CS-01074415-TRANS U-46619LQANGKSBLPMBTJ-YTQMDITASA-N9,11-DIDEOXY-9ALPHA, 11ALPHA-METHANOEPOXY-PROSTA-5E,13E-DIEN-1-OIC ACID5-Heptenoic acid, 7-[(1R,4S,5S,6R)-6-[(1E,3S)-3-hydroxy-1-octenyl]-2-oxabicyclo[2.2.1]hept-5-yl]-, (5E)- (9CI)
Datenbank-Bezeichner
- CAS
330796-58-2- PubChem CID
- 51522924
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,9
- Polarare Oberfläche (TPSA)
- 66,8 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 12
- Schwere Atome
- 25
- Formalladung
- 0
- Komplexität
- 457
Physikochemische Eigenschaften
- storage temp.
- -20 °C · Store at -20°C
- Löslichkeit
- 100 mg/ml · ≤100mg/ml in ethanol;100mg/ml in DMSO;100mg/ml in dimethyl formamide;2mg/ml in PBS(pH7.2)
- Aggregatzustand
- solution in acetate.
Chemie und Industrie
Anwendungen
VerwendenU-46619 is a TP receptor agonist that exhibits properties similar to Thromboxane A2, inducing platelet aggregation and vascular smooth muscle contraction. 5-trans U-46619 is a minor impurity (2-5%) which is variably present in most commercial preparations of U-46619. The biological activity of 5-trans U-46619 has rarely been tested separately from U-46619 itself. In the only case published to date, 5-trans U-46619 was found to be a about half as potent an inhibitor of Prostaglandin E synthase as the 5-cis version of U-46619.[Cayman Chemical]
Anbieter2 Anbieter
ChemeGen 中国18818260767 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Zugehörige Reaktionen
0
Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.
Notizen zur Verbindung
Wird geladen…