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右旋酮洛芬

右旋酮洛芬用途

S-(+)-Ketoprofen 是 COX-1 和 COX-2 的有效抑制剂,IC50 值分别为 1.9 和 27 nM。

右旋酮洛芬名称

[ CAS 号 ]:
22161-81-5

[ 中文名 ]:
右旋酮洛芬

[ 英文名 ]:
S-(+)-Ketoprofen

[中文别名 ]:

[英文别名 ]:

S-ketoprofen
(S)-Ketoprofen
(2S)-2-(3-Benzoylphenyl)propanoic acid
(S)-3-Benzoyl-a-methylbenzeneacetic Acid
MFCD00673316
Benzeneacetic acid, 3-benzoyl-α-methyl-, (αS)-
(+)-(S)-m-Benzoylhydratropic acid
Dexketoprofen
(+)-3-Benzoylhydratropic acid
Keral

右旋酮洛芬生物活性

[ 描述 ]:

S-(+)-Ketoprofen 是 COX-1 和 COX-2 的有效抑制剂,IC50 值分别为 1.9 和 27 nM。

[ 相关类别 ]:

研究领域 >> 炎症/免疫

[ 靶点 ]

COX-1:13 μM (IC50)

COX-2:370 μM (IC50)

[体外研究]

S -(+)-酮洛芬(化合物1)是COX-1和COX-2的有效抑制剂,IC50分别为1.9和27 nM [1]。

[参考文献]

[1]. Palomer A, et al. Modeling cyclooxygenase inhibition. Implication of active site hydration on the selectivity ofketoprofen analogues. J Med Chem. 2000 Jun 1;43(11):2280-4.

[相关活性小分子]

右旋酮洛芬物理化学性质

[ 密度 ]:
1.2±0.1 g/cm3

[ 沸点 ]:
431.3±28.0 °C at 760 mmHg

[ 熔点 ]:
75-78ºC(lit.)

[ 分子式 ]:
C₁₆H₁₄O₃

[ 分子量 ]:
254.281

[ 闪点 ]:
228.8±20.5 °C

[ 精确质量 ]:
254.094299

[ PSA ]:
54.37000

[ LogP ]:
2.81

[ 外观性状 ]:
白色或近乎于白色,结晶粉末

[ 蒸汽压 ]:
0.0±1.1 mmHg at 25°C

[ 折射率 ]:
1.592

[ 储存条件 ]:
-20°C Freezer

右旋酮洛芬MSDS

右旋酮洛芬毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CY1572790

CHEMICAL NAME :: Benzeneacetic acid, 3-benzoyl-alpha-methyl-, (S)-

CAS REGISTRY NUMBER :: 22161-81-5

LAST UPDATED :: 199606

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H14-O3

MOLECULAR WEIGHT :: 254.30

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 225 mg/kg/90D-I

TOXIC EFFECTS :: Gastrointestinal - other changes

REFERENCE :: TOXID9 Toxicologist. (Soc. of Toxicology, Inc., 475 Wolf Ledge Parkway, Akron, OH 44311) V.1- 1981- Volume(issue)/page/year: 30,101,1996

右旋酮洛芬安全信息

[ 符号 ]:

GHS06, GHS09

[ 信号词 ]:
Danger

[ 危害声明 ]:
H301-H315-H319-H335-H400

[ 警示性声明 ]:
P261-P273-P301 + P310-P305 + P351 + P338

[ 个人防护装备 ]:
dust mask type N95 (US);Eyeshields;Faceshields;Gloves

[ 危害码 (欧洲) ]:
Xn: Harmful;

[ 风险声明 (欧洲) ]:
R25;R36/37/38

[ 安全声明 (欧洲) ]:
26-60-61

[ 危险品运输编码 ]:
UN 2811 6

[ WGK德国 ]:
3

[ RTECS号 ]:
CY1572790

[ 危险类别 ]:
6.1

[ 海关编码 ]:
2942000000

右旋酮洛芬合成路线

右旋酮洛芬上下游产品

右旋酮洛芬上游产品

右旋酮洛芬下游产品

右旋酮洛芬海关

[ 海关编码 ]: 2942000000

右旋酮洛芬文献

Hologram QSAR model for the prediction of human oral bioavailability.

Bioorg. Med. Chem. 15 , 7738-45, (2007)

A drug intended for use in humans should have an ideal balance of pharmacokinetics and safety, as well as potency and selectivity. Unfavorable pharmacokinetics can negatively affect the clinical devel...

2-Arylpropionic CXC chemokine receptor 1 (CXCR1) ligands as novel noncompetitive CXCL8 inhibitors.

J. Med. Chem. 48 , 4312-31, (2005)

The CXC chemokine CXCL8/IL-8 plays a major role in the activation and recruitment of polymorphonuclear (PMN) cells at inflammatory sites. CXCL8 activates PMNs by binding the seven-transmembrane (7-TM)...

Scope of partial least-squares regression applied to the enantiomeric composition determination of ketoprofen from strongly overlapped chromatographic profiles.

J. Sep. Sci. 38 , 2423-30, (2015)

Valuable quantitative information could be obtained from strongly overlapped chromatographic profiles of two enantiomers by using proper chemometric methods. Complete separation profiles where the pea...

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