[4-({6-[Allyl(methyl)amino]hexyl}oxy)-2-fluorophenyl](4-bromophenyl)methanone (BioDeep_00000855778)
代谢物信息卡片
化学式: C23H27BrFNO2 (447.1209074)
中文名称:
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CN(CCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=C(C=C2)Br)F)CC=C
InChI: InChI=1S/C23H27BrFNO2/c1-3-14-26(2)15-6-4-5-7-16-28-20-12-13-21(22(25)17-20)23(27)18-8-10-19(24)11-9-18/h3,8-13,17H,1,4-7,14-16H2,2H3
数据库引用编号
5 个数据库交叉引用编号
- ChEBI: CHEBI:101064
- PubChem: 1949
- DrugBank: DB02016
- ChEMBL: CHEMBL304858
- CAS: 161582-11-2
分类词条
相关代谢途径
Reactome(0)
BioCyc(0)
PlantCyc(0)
代谢反应
0 个相关的代谢反应过程信息。
Reactome(0)
BioCyc(0)
WikiPathways(0)
Plant Reactome(0)
INOH(0)
PlantCyc(0)
COVID-19 Disease Map(0)
PathBank(0)
PharmGKB(0)
0 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：
- PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。
文献列表
- Zhen Ding, Yanan Gu, Dake Huang, Hong Zhou, Tingting Zhu, Xin Luo, Sumei Zhang, Shengquan Zhang, Yeben Qian. Cholesterol biosynthesis inhibitor RO 48‑8071 inhibits pancreatic ductal adenocarcinoma cell viability by deactivating the JNK and ERK/MAPK signaling pathway.
Molecular medicine reports.
2021 12; 24(6):. doi:
10.3892/mmr.2021.12468. [PMID: 34590153] - Elisabet Gas-Pascual, Biljana Simonovik, Hubert Schaller, Thomas J Bach. Inhibition of Cycloartenol Synthase (CAS) Function in Tobacco BY-2 Cells.
Lipids.
2015 Aug; 50(8):761-72. doi:
10.1007/s11745-015-4036-6. [PMID: 26033687] - Elisabet Gas-Pascual, Biljana Simonovik, Dimitri Heintz, Marc Bergdoll, Hubert Schaller, Thomas J Bach. Inhibition of Cycloartenol Synthase (CAS) Function in Tobacco BY-2 Cell Suspensions: A Proteomic Analysis.
Lipids.
2015 Aug; 50(8):773-84. doi:
10.1007/s11745-015-4041-9. [PMID: 26123692] - Jen-Chieh Chuang, Mark A Valasek, Adam M Lopez, Kenneth S Posey, Joyce J Repa, Stephen D Turley. Sustained and selective suppression of intestinal cholesterol synthesis by Ro 48-8071, an inhibitor of 2,3-oxidosqualene:lanosterol cyclase, in the BALB/c mouse.
Biochemical pharmacology.
2014 Apr; 88(3):351-63. doi:
10.1016/j.bcp.2014.01.031. [PMID: 24486573] - Stefanie Lange, Marco Keller, Christoph Müller, Simonetta Oliaro-Bosso, Gianni Balliano, Franz Bracher. Aminopropylindenes derived from Grundmann's ketone as a novel chemotype of oxidosqualene cyclase inhibitors.
European journal of medicinal chemistry.
2013 May; 63(?):758-64. doi:
10.1016/j.ejmech.2013.03.002. [PMID: 23583910] - G A Clarke, G Bouchard, B Paigen, M C Carey. Cholesterol synthesis inhibition distal to squalene upregulates biliary phospholipid secretion and counteracts cholelithiasis in the genetically prone C57L/J mouse.
Gut.
2004 Jan; 53(1):136-42. doi:
10.1136/gut.53.1.136. [PMID: 14684588] - Henrietta Dehmlow, Johannes D Aebi, Synèse Jolidon, Yu-Hua Ji, Elisabeth M von der Mark, Jacques Himber, Olivier H Morand. Synthesis and structure-activity studies of novel orally active non-terpenoic 2,3-oxidosqualene cyclase inhibitors.
Journal of medicinal chemistry.
2003 Jul; 46(15):3354-70. doi:
10.1021/jm021120f. [PMID: 12852766] - I Abe, Y F Zheng, G D Prestwich. Photoaffinity labeling of oxidosqualene cyclase and squalene cyclase by a benzophenone-containing inhibitor.
Biochemistry.
1998 Apr; 37(17):5779-84. doi:
10.1021/bi980366c. [PMID: 9558310] - O H Morand, J D Aebi, H Dehmlow, Y H Ji, N Gains, H Lengsfeld, J Himber. Ro 48-8.071, a new 2,3-oxidosqualene:lanosterol cyclase inhibitor lowering plasma cholesterol in hamsters, squirrel monkeys, and minipigs: comparison to simvastatin.
Journal of lipid research.
1997 Feb; 38(2):373-90. doi:
10.1016/s0022-2275(20)37449-6. [PMID: 9162756]