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6493-05-6

中文名称 己酮可可碱
英文名称 Pentoxifylline
CAS 6493-05-6
EINECS 编号 229-374-5
分子式 C13H18N4O3
MDL 编号 MFCD00063379
分子量 278.31
MOL 文件 6493-05-6.mol
更新日期 2024/04/19 16:16:15
6493-05-6 结构式 6493-05-6 结构式

基本信息

中文别名
1-(5-氧代己基)可可碱
3,7-二氢-3,7-二甲基-1-(5-氧己基)-1H-嘌呤-2,6-二酮
已酮可可豆碱
已酮可可碱
己酮可可碱
英文别名
3,7-DIHYDRO-3,7-DIMETHYL-1-(5-OXOHEXYL)-1H-PURINE-2,6-DIONE
PENTOXIFYLLINE
PENTOXYFYLLINE
PENTOXYIFYLLINE
PENTOXYPHYLINE
PTX
TRENTAL
1-(5-Oxohexyl)-3,7-dimethylxanthine
1-(5-oxohexyl)-theobromin
1-(5-Oxohexyl)theobromine
1-(5-oxohexyl)-Theobromine
1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-1-(5-oxohexyl)-
3,7-dihydro-3,7-dimethyl-1-(5-oxohexyl)-1h-purine-6-dione
3,7-Dimethyl-1-(5-oxohexyl)-1H,3H-purin-2,6-dione
3,7-Dimethyl-1-(5-oxohexyl)-3,7-dihydro-1H-purine-2,6-dione
3,7-Dimethyl-1-(5-oxohexyl)xanthine
Azupentat
BL 191
bl191
Dimethyloxohexylxanthine
所属类别
原料药:周围血管扩张药

物理化学性质

外观性状白色针状结晶。熔点105℃。易溶于水、苯、乙醇、氯仿,微溶于乙醇。无臭,味苦。
熔点98-100°C
沸点421.13°C (rough estimate)
密度1.1713 (rough estimate)
折射率1.6000 (estimate)
储存条件Sealed in dry,Room Temperature
溶解度H2O: ≥43 mg/mL
酸度系数(pKa)0.50±0.70(Predicted)
形态solid
颜色white
最大波长(λmax)276nm(lit.)
Merck14,7136
NIST化学物质信息Pentoxifylline(6493-05-6)

安全数据

危险性符号(GHS)
GHS07
警示词警告
危险性描述H302
危险品标志Xn
危险类别码R22
安全说明S36
WGK Germany3
RTECS号XH2475000
海关编码2939590000
毒性LD50 orally in mice: 1385 mg/kg (Popendiker)

应用领域

用途一
该品为血管扩张药,能改善脑和四肢的血液循环。小鼠口服LD50为1385mg/kg。

制备方法

方法一
由1,3-溴氯丙烷与乙酰乙酸乙酯在80℃左右环合得到2-甲基-3-乙氧羰基-5,6-二氢吡喃,再将其开环、溴化生成1-溴-5-已酮,然后与可可碱钠盐缩合制成已酮可可碱。

知名试剂公司产品信息

己酮可可碱价格(试剂级)
报价日期产品编号产品名称CAS号包装价格
2024/01/25HY-B0715己酮可可碱
Pentoxifylline
6493-05-6500mg400元
2024/01/25HY-B0715己酮可可碱
Pentoxifylline
6493-05-610mM * 1mLin DMSO500元
2024/01/25HY-B0715己酮可可碱
Pentoxifylline
6493-05-61g500元

常见问题列表

生物活性
Pentoxifylline (BL-191) 是一种血液流变学改善剂。Pentoxifylline 是一种具有口服活性的,非选择性的磷酸二酯酶 (PDE) 抑制剂,具有免疫调节、抗炎、血液流变学改善、抗纤溶和抗增殖作用。Pentoxifylline 可用于研究周围血管疾病、脑血管疾病和其他一些涉及局部微循环缺陷的疾病。
靶点

PDE

体外研究

Pentoxifylline (0.1-50 mM; 24-48 hours) inhibits cell proliferation in a dose-dependent manner.
Pentoxifylline (0.5 mM; 12-36 hours) increases apoptosis and decreases autophagy levels in MDA-MB-231 cells.
Pentoxifylline (0.5 mM; 12-36 hours) induces autophagy in MDA-MB-231 cells.
Pentoxifylline (0.5 mM; 24-48 hours) blocks cell cycle at the G0/G1 phase.
Pentoxifylline results in high LC3-II/LC3-ratio.

Cell Autophagy Assay

Cell Line: MDA-MB-231 cells
Concentration: 0.1 mM, 1 mM, 5 mM , 10 mM, 50 mM
Incubation Time: 24 hours, 48 hours
Result: Inhibited cell proliferation in a dose-dependent manner.

Apoptosis Analysis

Cell Line: MDA-MB-231 cells
Concentration: 0.5 mM
Incubation Time: 12 hours, 24 hours, 36 hours
Result: Induced apoptosis.

Apoptosis Analysis

Cell Line: MDA-MB-231 cells
Concentration: 0.5 mM
Incubation Time: 24 hours, 48 hours
Result: Induced approximately 20-28% of cell autophagy.

Cell Cycle Analysis

Cell Line: MDA-MB-231 cells
Concentration: 0.5 mM
Incubation Time: 24 hours, 48 hours
Result: Induced G0/G1 phase arrest.

Western Blot Analysis

Cell Line: MDA-MB-231 cells
Concentration: 0.5 mM
Incubation Time: 24 hours, 48 hours
Result: Induced high LC3-II/LC3-ratio.
体内研究

Pentoxifylline (200 mg/kg; i.p.) has a protective effect on rats with transient global ischemia and could reduce cognitive impairment.

Animal Model: Adult male Wistar rats 12-13-weeks-old (250-300 g)
Dosage: 200 mg/kg
Administration: Intraperitoneal injection, at 1hr before and 3 hr after ischemia
Result: Significantly improved the spatial memory and effects were significant different from those of sham-operated and vehicle groups.
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