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methyl (2S)-2-[[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino]-3-(1H-indol-3-yl)propanoate

更新时间:2025-10-05 17:37:01

methyl (2S)-2-[[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino]-3-(1H-indol-3-yl)propanoate结构式
methyl (2S)-2-[[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino]-3-(1H-indol-3-yl)propanoate结构式
委托求购
常用名 methyl (2S)-2-[[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino]-3-(1H-indol-3-yl)propanoate 英文名 methyl (2S)-2-[[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino]-3-(1H-indol-3-yl)propanoate
CAS号 1532533-68-8 分子量 520.6
密度 N/A 沸点 N/A
分子式 C29H32N2O7 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 methyl (2S)-2-[[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino]-3-(1H-indol-3-yl)propanoate

 物理化学性质

分子式 C29H32N2O7
分子量 520.6
InChIKey NMPRQNFXEIFZOU-PNOMZVSUSA-N
SMILES COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CCC(C)=CCc1c(O)c2c(c(C)c1OC)COC2=O

 靶点实验

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来源:ChEMBL
靶标:PC-3
External Id:CHEMBL3101577
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来源:ChEMBL
靶标:DU-145
External Id:CHEMBL3101578
实验名称:Inhibition of IMPDH1 (unknown origin)
来源:ChEMBL
靶标:Inosine-5'-monophosphate dehydrogenase 1
External Id:CHEMBL3101581
实验名称:Inhibition of IMPDH2 (unknown origin)
来源:ChEMBL
靶标:Inosine-5'-monophosphate dehydrogenase 2
External Id:CHEMBL3101582
实验名称:Antiproliferative activity against human HL60 cells
来源:ChEMBL
靶标:HL-60
External Id:CHEMBL3101585
实验名称:Antiproliferative activity against human K562 cells
来源:ChEMBL
靶标:K562
External Id:CHEMBL3101586
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