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名称

GSK2838232

英文名称

GSK2838232

货号

G406812-100mg

包装规格

100mg

浓度

≥98%

储存温度

-20°C储存

运输条件

超低温冰袋运输

产品介绍

GSK2838232是HIV-1成熟的抑制剂. HIV-1成熟的抑制剂破坏HIV-1蛋白酶对HIV-1 gag蛋白直接前体的裂解.成熟抑制剂与gag蛋白结合,导致不成熟\非感染性的病毒颗粒形成,其不能感染其它细胞.此外,成熟抑制剂抑制HIV感染的耐受性. GSK2838232是HIV-1成熟的抑制剂,具有广谱的抗病毒活性,包括bevirimat抗性菌株.GSK2838232用于治疗慢性艾滋病毒感染.HIV阴性个体的I期研究已经完成.使用5\10或20 mg单一剂量的GSK2838232评价初始安全性\耐受性\药代动力学特性以及食物和利托那韦对GSK2838232的生物利用度和药代动力学的效应. Product Introduction GSK2838232, a betulin derivative, is an inhibitor of human immune virus (HIV) maturation which is potential for the treatment of chronic HIV infection.

CAS号

1443461-21-9

分子式

C48H73ClN2O6

分子量

809.56 g/mol

PubChem编号

89634981

Isomeric SMILES

CC(C)C1=C2[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC[C@]2(CC1=O)[C@H](CN(CCN(C)C)CC6=CC(=CC=C6)Cl)O)C)C)(C)C)OC(=O)CC(C)(C)C(=O)O)C

IIUPAC Name

4-[[(3aR,5aR,5bR,7aR,9S,11aR,11bR,13aS)-3a-[(1R)-2-[(3-chlorophenyl)methyl-[2-(dimethylamino)ethyl]amino]-1-hydroxyethyl]-5a,5b,8,8,11a-pentamethyl-2-oxo-1-propan-2-yl-4,5,6,7,7a,9,10,11,11b,12,13,13a-dodecahydro-3H-cyclopenta[a]chrysen-9-yl]oxy]-2,2-dimethyl-4-oxobutanoic acid

INCHI

1S/C48H73ClN2O6/c1-30(2)40-34(52)26-48(37(53)29-51(24-23-50(10)11)28-31-13-12-14-32(49)25-31)22-21-46(8)33(41(40)48)15-16-36-45(7)19-18-38(57-39(54)27-43(3,4)42(55)56)44(5,6)35(45)17-20-47(36,46)9/h12-14,25,30,33,35-38,53H,15-24,26-29H2,1-11H3,(H,55,56)/t33-,35+,36-,37+,38+,45+,46-,47-,48+/m1/s1

InChi Key

DSNMRZSQABDJDK-PZFKGGKESA-N

Smiles

CC(C)C1=C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CC1=O)C(CN(CCN(C)C)CC6=CC(=CC=C6)Cl)O)C)C)(C)C)OC(=O)CC(C)(C)C(=O)O)C

PubChem CID

89634981

溶解性

Soluble in DMSO

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

808.516 Da

单同位素质量Monoisotopic Mass

808.516 Da

拓扑极表面积Topological Polar Surface Area

107.000 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

1570.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

7.200

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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