Andarine (BioDeep_00000720515)
代谢物信息卡片
化学式: C19H18F3N3O6 (441.1148)
中文名称: N-[4-硝基-3-(三氟甲基)苯基]-(2S)-3-[4-(乙酰基氨基)苯氧基]-2-羟基-2-甲基丙酰胺
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CC(=O)NC1=CC=C(C=C1)OCC(C)(C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)O
InChI: InChI=1S/C19H18F3N3O6/c1-11(26)23-12-3-6-14(7-4-12)31-10-18(2,28)17(27)24-13-5-8-16(25(29)30)15(9-13)19(20,21)22/h3-9,28H,10H2,1-2H3,(H,23,26)(H,24,27)/t18-/m0/s1
数据库引用编号
5 个数据库交叉引用编号
- ChEBI: CHEBI:94760
- PubChem: 9824562
- DrugBank: DB07423
- ChEMBL: CHEMBL125236
- CAS: 401900-40-1
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。
| 亚细胞结构定位 | 关联基因列表 |
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文献列表
- Neeraj Garg, Annelie Hansson, Heather K Knych, Scott D Stanley, Mario Thevis, Ulf Bondesson, Mikael Hedeland, Daniel Globisch. Structural elucidation of major selective androgen receptor modulator (SARM) metabolites for doping control.
Organic & biomolecular chemistry.
2018 01; 16(5):698-702. doi:
10.1039/c7ob03030d. [PMID: 29319101] - Annelie Hansson, Heather Knych, Scott Stanley, Mario Thevis, Ulf Bondesson, Mikael Hedeland. Investigation of the selective androgen receptor modulators S1, S4 and S22 and their metabolites in equine plasma using high-resolution mass spectrometry.
Rapid communications in mass spectrometry : RCM.
2016 Apr; 30(7):833-42. doi:
10.1002/rcm.7512. [PMID: 26969924] - Eva de Rijke, Martien L Essers, Jeroen C W Rijk, Mario Thevis, Toine F H Bovee, Leendert A van Ginkel, Saskia S Sterk. Selective androgen receptor modulators: in vitro and in vivo metabolism and analysis.
Food additives & contaminants. Part A, Chemistry, analysis, control, exposure & risk assessment.
2013; 30(9):1517-26. doi:
10.1080/19440049.2013.810346. [PMID: 23883284] - Elia Grata, Laurent Perrenoud, Martial Saugy, Norbert Baume. SARM-S4 and metabolites detection in sports drug testing: a case report.
Forensic science international.
2011 Dec; 213(1-3):104-8. doi:
10.1016/j.forsciint.2011.07.014. [PMID: 21816554] - Mario Thevis, Andreas Thomas, Gregor Fusshöller, Simon Beuck, Hans Geyer, Wilhelm Schänzer. Mass spectrometric characterization of urinary metabolites of the selective androgen receptor modulator andarine (S-4) for routine doping control purposes.
Rapid communications in mass spectrometry : RCM.
2010 Aug; 24(15):2245-54. doi:
10.1002/rcm.4637. [PMID: 20623476] - Minoli A Perera, Donghua Yin, Di Wu, Kenneth K Chan, Duane D Miller, James Dalton. In vivo metabolism and final disposition of a novel nonsteroidal androgen in rats and dogs.
Drug metabolism and disposition: the biological fate of chemicals.
2006 Oct; 34(10):1713-21. doi:
10.1124/dmd.106.009985. [PMID: 16815963] - Wenqing Gao, Peter J Reiser, Christopher C Coss, Mitch A Phelps, Jeffrey D Kearbey, Duane D Miller, James T Dalton. Selective androgen receptor modulator treatment improves muscle strength and body composition and prevents bone loss in orchidectomized rats.
Endocrinology.
2005 Nov; 146(11):4887-97. doi:
10.1210/en.2005-0572. [PMID: 16099859] - J D Kearbey, D Wu, W Gao, D D Miller, J T Dalton. Pharmacokinetics of S-3-(4-acetylamino-phenoxy)-2-hydroxy-2-methyl-N-(4-nitro- 3-trifluoromethyl-phenyl)-propionamide in rats, a non-steroidal selective androgen receptor modulator.
Xenobiotica; the fate of foreign compounds in biological systems.
2004 Mar; 34(3):273-80. doi:
10.1080/0049825041008962. [PMID: 15204699]
