[4-[(2S,3S,5S,8R,9S,10S,13S,14S,17R)-17-ethynyl-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-2-yl]piperazin-1-yl]-[(2S)-1-(quinoline-2-carbonyl)pyrrolidin-2-yl]methanone

• 常用名: [4-[(2S,3S,5S,8R,9S,10S,13S,14S,17R)-17-ethynyl-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-2-yl]piperazin-1-yl]-[(2S)-1-(quinoline-2-carbonyl)pyrrolidin-2-yl]methanone
• 英文名: [4-[(2S,3S,5S,8R,9S,10S,13S,14S,17R)-17-ethynyl-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-2-yl]piperazin-1-yl]-[(2S)-1-(quinoline-2-carbonyl)pyrrolidin-2-yl]methanone
• CAS号: 1228036-74-5
• 分子量: 652.9
• 密度: N/A
• 沸点: N/A
• 分子式: C₄₀H₅₂N₄O₄
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: [4-[(2S,3S,5S,8R,9S,10S,13S,14S,17R)-17-ethynyl-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-2-yl]piperazin-1-yl]-[(2S)-1-(quinoline-2-carbonyl)pyrrolidin-2-yl]methanone

物理化学性质

• 分子式: C₄₀H₅₂N₄O₄
• 分子量: 652.9
• InChIKey: HOUNMJYTCWEHQD-WGQHWTFVSA-N
• SMILES: C#CC1(O)CCC2C3CCC4CC(O)C(N5CCN(C(=O)C6CCCN6C(=O)c6ccc7ccccc7n6)CC5)CC4(C)C3CCC21C

靶点实验

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实验名称：Plasma concentration in Sprague-Dawley rat at 2.3 mg/kg, sc measured at 12 hrs by LC/... 来源：ChEMBL 靶标：Plasma External Id：CHEMBL3382598

实验名称：Plasma concentration in Sprague-Dawley rat at 2.3 mg/kg, sc measured at 3 hrs by LC/M... 来源：ChEMBL 靶标：Plasma External Id：CHEMBL3382597

实验名称：Cytotoxicity against human peripheral blood lymphocytes assessed as assessed as CD4+/... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375836

实验名称：Solubility of compound in PBS at pH 7.4 at 300 uM after 24 hrs by HPLC-UV analysis 来源：ChEMBL 靶标：N/A External Id：CHEMBL4683204

实验名称：Cytotoxicity against human peripheral blood lymphocytes assessed as assessed as CD3+/... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375218

实验名称：Cytotoxicity against human peripheral blood lymphocytes assessed as assessed as CD3+/... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375217

实验名称：Cytotoxicity against human peripheral blood lymphocytes assessed as assessed as CD3+/... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375220

实验名称：Cytotoxicity against human peripheral blood lymphocytes assessed as assessed as CD3+/... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375219

实验名称：Cytotoxicity against human peripheral blood lymphocytes assessed as assessed as CD3+/... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375222

实验名称：Cytotoxicity against human peripheral blood lymphocytes assessed as assessed as CD3+/... 来源：ChEMBL 靶标：N/A External Id：CHEMBL3375221

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