[(1S,3R,5R,6aS,7S,8S,9R,10R,10aS)-1-acetyloxy-3-butanoyloxy-10-hydroxy-5-methoxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-9-yl] butanoate

• 常用名: [(1S,3R,5R,6aS,7S,8S,9R,10R,10aS)-1-acetyloxy-3-butanoyloxy-10-hydroxy-5-methoxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-9-yl] butanoate
• 英文名: [(1S,3R,5R,6aS,7S,8S,9R,10R,10aS)-1-acetyloxy-3-butanoyloxy-10-hydroxy-5-methoxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-9-yl] butanoate
• CAS号: 134955-65-0
• 分子量: 562.7
• 密度: N/A
• 沸点: N/A
• 分子式: C₃₁H₄₆O₉
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: [(1S,3R,5R,6aS,7S,8S,9R,10R,10aS)-1-acetyloxy-3-butanoyloxy-10-hydroxy-5-methoxy-7,8-dimethyl-7-[(2E)-3-methylpenta-2,4-dienyl]-1,3,5,6,6a,8,9,10-octahydrobenzo[d][2]benzofuran-9-yl] butanoate

物理化学性质

• 分子式: C₃₁H₄₆O₉
• 分子量: 562.7
• InChIKey: SBQNYWSGQZHIRT-YRPGVFIESA-N
• SMILES: C=CC(C)=CCC1(C)C(C)C(OC(=O)CCC)C(O)C23C(=CC(OC)CC12)C(OC(=O)CCC)OC3OC(C)=O

靶点实验

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实验名称：Inhibition of pig kidney outer medulla Na+,K+-ATPase at 50 uM relative to control 来源：ChEMBL 靶标：N/A External Id：CHEMBL3587749

实验名称：Cytotoxicity against human CCRF-CEM cells assessed as cell viability after 24 hrs by ... 来源：ChEMBL 靶标：CCRF-CEM External Id：CHEMBL3587750

实验名称：NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell... 来源：DTP/NCI 靶标：N/A External Id：IGROV1_OneDose

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