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基本情報
- CAS
188062-50-2- 標準SMILES
Nc1nc(NC2CC2)c2ncn([C@H]3C=C[C@@H](CO)C3)c2n1.Nc1nc(NC2CC2)c2ncn([C@H]3C=C[C@@H](CO)C3)c2n1.O=S(=O)(O)O- 分子式
- C14H20N6O5S
- 平均分子量
- 384.41 g/mol
名称と識別子
- 優先名称
- Abacavir sulfate
- 現地名
- 硫酸アバカビル
- 英語名
- Abacavir sulfate
- 分子式
- C14H20N6O5S
- 分子量
- 384.41
名称と別名
硫酸アバカビル硫酸アバカビル RACEMIC (4-[2-AMINO-6-(CYCLOPROPYLAMINO)-9H-PURIN-9YL]-2-CYCLOPENTENE-1-METHANOL SULFATE (2:1))アバカビル硫酸塩アバカビル スルファートアバカビル硫酸塩 (JAN)(1S)-4α-[2-アミノ-6-(シクロプロピルアミノ)-9H-プリン-9-イル]-2-シクロペンテン-1-メタノール・0.5硫酸ABACAVIR SULPHATEZIAGENAbacavir HemisulfateAbacavir Sulfate RaceMicDRG 0257Hsdb 7154
名称をさらに表示
ABC sulfate1592U89 sulfateUnii-J220T4J9Q2bacavir sulfate
データベース識別子
- CAS
188062-50-2、2736655-48-2- PubChem CID
- 441384
- ChEMBL
CHEMBL4303288- ChEBI
CHEBI:2361- UNII
- 1PPL256S5A、J220T4J9Q2
- EC Number
- 620-488-4
物性
物理化学的性質
- 融点
- 222 · 222-225°C
- 貯蔵温度
- 2 · 2-8°C
- 溶解性
- 2 O: · H2O: ≥17mg/mL
- 外見
- 粉
- 色
- 白から黄褐色
- 水溶解度
- 1.68 ug/L · 1.68ug/L(32℃)
- BCS Class
- 3 · 3
- InChIKey
- MBFKCGGQTYQTLR-YFYURQRANA-N
- SMILES
- S(O)(O)(=O)=O.N(C1CC1)C1N=C(N)N=C2N([C@H]3C=C[C@@H](CO)C3)C=NC=12 |&1:16,19,r|
- CAS データベース
- 188062 · 188062-50-2(CAS DataBase Reference)
化学的性質
化学的特性Abacavir sulfate is white to off-white crystalline powder and the solubility is pH dependent with minimal solubility at basic pH and increased solubility at acid. This active substance is slightly soluble in diethyl ether and ethanol. Abacavir exhibits stereoisomerism due to the presence of two chiral centres (1S,4R absolute configuration).
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
安全データ
- wgk
- 3
- hs_code
- 2933595960
- risk_code
- 63-40
- hazard_code
- Xn
- safety_code
- 36/37
- Hazard Classifications
- Carc. 2Eye Irrit. 2Muta. 2Repr. 2Skin Sens. 1
- ストレージクラス
- 11 - Combustible Solids
- 有毒物質データの
- 188062-50-2(Hazardous Substances Data)
化学と産業
応用分野
用途核酸アナログ逆転写酵素阻害 剤です。dGTP と競合し、ウイルス DNA に取 り込まれ、逆転写酵素の活性を阻害します。 DNA 鎖の伸長を停止することにより、ウイル ス増殖抑制作用を示します。
説明Abacavir sulfate was first launched as Ziagen in the US for the treatment of human immunodeficiency virus (HIV) infection, in combination with other antiretroviral drugs. Abacavir is a carbocyclic nucleoside reverse transcriptase inhibitor (nRTI); it is one of the most potent anti-HIV agents to date. In vitro, Abacavir is a potent and selective inhibitor of HIV-1 and HIV-2 replication. Resistance to Abacavir develops more slowly than for other anti-HIV agents. Abacavir is highly synergistic with protease inhibitors such as Amprenavir. In clinical trials for HIV infections in adults, it produced durable suppression in viral load. Combinations with different protease inhibitors such as Nelfinavir, Saquinavir or Indinavir markedly reduced plasma viral load to undetectable levels for at least 48 weeks, and significantly raised CD4+ cell counts in adults with HIV infection, especially nRTI-naive patients. Abacavir has a good oral availability and its penetration into CSF is much more significant than for other anti-HIV drugs. The two major metabolites identified in humans were the 5'-carboxylate and the 5'-glucuronide, mainly excreted via the renal route.
使用Abacavir sulfate is a nucleoside reverse transcriptase inhibitor (NRTI) used for the treatment of HIV-1 infection and anti-AIDS drug. It has been used in the cytotoxicity to test its tumour promoting activity U937 cells.
一般的な説明Abacavir sulfate belongs to the class of human immunodeficiency virus (HIV) medicines called nucleoside reverse transcriptase inhibitors, with antiretroviral activity against HIV.Pharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards.
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