(2S)-3-{4-[1-ethyl-1-(4-{[(2R)-2-hydroxy-3,3-dimethylbutyl]oxy}-3-methylphenyl)propyl]-2-methylphenoxy}propane-1,2-diol

• 常用名: (2S)-3-{4-[1-ethyl-1-(4-{[(2R)-2-hydroxy-3,3-dimethylbutyl]oxy}-3-methylphenyl)propyl]-2-methylphenoxy}propane-1,2-diol
• 英文名: (2S)-3-{4-[1-ethyl-1-(4-{[(2R)-2-hydroxy-3,3-dimethylbutyl]oxy}-3-methylphenyl)propyl]-2-methylphenoxy}propane-1,2-diol
• CAS号: 905952-20-7
• 分子量: 458.6
• 密度: N/A
• 沸点: N/A
• 分子式: C₂₈H₄₂O₅
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: (2S)-3-{4-[1-ethyl-1-(4-{[(2R)-2-hydroxy-3,3-dimethylbutyl]oxy}-3-methylphenyl)propyl]-2-methylphenoxy}propane-1,2-diol

物理化学性质

• 分子式: C₂₈H₄₂O₅
• 分子量: 458.6
• InChIKey: AIKLCYAFOOBGEV-OZXSUGGESA-N
• SMILES: CCC(CC)(C1=CC(=C(C=C1)OC[C@H](CO)O)C)C2=CC(=C(C=C2)OC[C@@H](C(C)(C)C)O)C

靶点实验

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实验名称：Binding affinity to VDR receptor 来源：ChEMBL 靶标：Vitamin D3 receptor External Id：CHEMBL1273734

实验名称：Binding affinity to VDR relative to (1-alpha 25-(OH)2D3 来源：ChEMBL 靶标：Vitamin D3 receptor External Id：CHEMBL948045

实验名称：Activity at human VDR expressed in human HOS cells transfected with pGL3-hOc, pCDNA-h... 来源：ChEMBL 靶标：Vitamin D3 receptor External Id：CHEMBL1837875

实验名称：Vitamin-D activity at VDR receptor in human HL60 cells assessed as induction of cell ... 来源：ChEMBL 靶标：Vitamin D3 receptor External Id：CHEMBL1274500

实验名称：Agonist activity at human VDR expressed in HEK293 cells co-expressing CMX-GAL4N and T... 来源：ChEMBL 靶标：Vitamin D3 receptor External Id：CHEMBL3637069

实验名称：Binding affinity to androgen receptor 来源：ChEMBL 靶标：Androgen receptor External Id：CHEMBL1273732

实验名称：Agonist activity at human VDR expressed in HOS cells co-expressing human RXR by Dual-... 来源：ChEMBL 靶标：Vitamin D3 receptor External Id：CHEMBL4383861

实验名称：Antiandrogen activity against androgen receptor in androgen-dependent mouse SC3 cells... 来源：ChEMBL 靶标：Androgen receptor External Id：CHEMBL1273733

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