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名称

Celgosivir hydrochloride

分子类型

小分子

别名

盐酸西戈西韦

英文名称

Celgosivir hydrochloride

货号

C649960-5mg

包装规格

5mg

浓度

≥98%

储存温度

2-8°C储存,干燥

运输条件

冰袋运输

产品介绍

Celgosivir hydrochloride (MBI 3253 hydrochloride; MDL 28574 hydrochloride; MX3253 hydrochloride) is an α-glucosidase I inhibitor; inhibits bovine viral diarrhoea virus (BVDV) with an IC 50 of 1.27 μM in in vitro assay. In Vitro Celgosivir is more effective (IC 50 =20 μM) than the parent molecule (IC 50 =254 μM) at causing the accumulation of glucosylated oligosaccharides in HIV-infected cells by inhibition of glycoprotein processing. Celgosivir exhibits potent antiviral activity against HIV-1 with an IC 50 of 2.0±2.3 μM. Bovine viral diarrhoea virus (BVDV) is a closely related virus of hepatitis C virus (HCV). Celgosivir inhibits BVDV with IC 50 values of 16 and 47 μM in plaque assay and cytopathic effect assay, respectively. Celgosivir inhibits DENV2 replication with an EC 50 of 0.2 μM. The EC 50 values against DENV1, 3 and 4 are less than 0.7 μM. MCE has not independently confirmed the accuracy of these methods. They are for reference only. In Vivo Celgosivir fully protects AG129 mice from lethal infection with a mouse adapted dengue virus at a dose of 50 mg/kg twice daily (BID) for 5 days and is effective even after 48 h delayed treatment. The protection by celgosivir is dose- and schedule-dependent and that a twice-a-day regimen of 50, 25 or 10 mg/kg is more protective than a single daily dose of 100 mg/kg. Pharmacokinetics studies of celgosivir in mice shows that it rapidly metabolizes to castanospermine. During primary infection with a mouse-adapted DENV strain S221, mice shows increased viremia on day 3, yet 80% survived day 10 with virus completely cleared by day 8. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Form:Solid IC50& Target:IC50: 1.27 μM (α-glucosidase I)

生化机理

Celgosivir hydrochloride（MBI 3253 hydrochloride；MDL 28574 hydrochloride；MX3253 hydrochloride）是一种α-葡萄糖苷酶 I 抑制剂；对牛病毒性腹泻病毒（BVDV）有抑制作用，体外检测的 IC 50 为 1.27 μM。

CAS号

141117-12-6

分子式

C12H22ClNO5

分子量

295.76 g/mol

PubChem编号

3033824

Isomeric SMILES

CCCC(=O)O[C@H]1CN2CC[C@@H]([C@@H]2[C@H]([C@@H]1O)O)O.Cl

Smiles

CCCC(=O)O[C@H]1CN2CC[C@@H]([C@@H]2[C@H]([C@@H]1O)O)O.Cl

PubChem CID

3033824

溶解性

H2O : ≥ 100 mg/mL (338.11 mM) DMSO : 100 mg/mL (338.11 mM; Need ultrasonic)

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

295.119 Da

单同位素质量Monoisotopic Mass

295.119 Da

拓扑极表面积Topological Polar Surface Area

90.200 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

311

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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