Ethylphenidate (BioDeep_00000178912)
Secondary id: BioDeep_00000272280
human metabolite blood metabolite
代谢物信息卡片
化学式: C15H21NO2 (247.15722060000002)
中文名称: 混旋哌乙酯碱
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CCOC(=O)C(C1CCCCN1)C1=CC=CC=C1
InChI: InChI=1S/C15H21NO2/c1-2-18-15(17)14(12-8-4-3-5-9-12)13-10-6-7-11-16-13/h3-5,8-9,13-14,16H,2,6-7,10-11H2,1H3
描述信息
D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018759 - Adrenergic Uptake Inhibitors
D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors
D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants
D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents
D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents
D049990 - Membrane Transport Modulators
同义名列表
数据库引用编号
7 个数据库交叉引用编号
- PubChem: 3080846
- HMDB: HMDB0252084
- ChEMBL: CHEMBL1187932
- ChEMBL: CHEMBL534479
- chemspider: 2338571
- CAS: 57413-43-1
- KEGG: C22752
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)
1 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
- Sarah L Belsey, Robert J Flanagan. Analytical Detection of Novel Stimulants by Immunoassay and Liquid Chromatography-High Resolution Mass Spectrometry: Case Studies on Ethylphenidate and Mephedrone.
Journal of analytical toxicology.
2021 May; 45(5):521-528. doi:
10.1093/jat/bkaa102. [PMID: 32816012] - Heather K Knych, Dan S McKemie, Kelsey Seminoff, Petra Hartmann, Lynn Hovda, Dionne Benson. L- and D-threo ethylphenidate concentrations, pharmacokinetics, and pharmacodynamics in horses.
Drug testing and analysis.
2018 Oct; 10(10):1508-1517. doi:
10.1002/dta.2408. [PMID: 29786965] - Bernardino Barceló, Isabel Gomila, Maria Concetta Rotolo, Emilia Marchei, Chrystalla Kyriakou, Simona Pichini, Carolina Roset, Miguel Ángel Elorza, Francesco Paolo Busardò. Intoxication caused by new psychostimulants: analytical methods to disclose acute and chronic use of benzofurans and ethylphenidate.
International journal of legal medicine.
2017 Nov; 131(6):1543-1553. doi:
10.1007/s00414-017-1648-9. [PMID: 28710651] - George P Bailey, James H Ho, Simon Hudson, Alison Dines, John Rh Archer, Paul I Dargan, David M Wood. Nopaine no gain: recreational ethylphenidate toxicity.
Clinical toxicology (Philadelphia, Pa.).
2015 Jun; 53(5):498-9. doi:
10.3109/15563650.2015.1033062. [PMID: 25871917] - Markus R Meyer, Aline Schütz, Hans H Maurer. Contribution of human esterases to the metabolism of selected drugs of abuse.
Toxicology letters.
2015 Jan; 232(1):159-66. doi:
10.1016/j.toxlet.2014.10.026. [PMID: 25445008] - J Krueger, H Sachs, F Musshoff, T Dame, J Schaeper, M Schwerer, M Graw, G Roider. First detection of ethylphenidate in human fatalities after ethylphenidate intake.
Forensic science international.
2014 Oct; 243(?):126-9. doi:
10.1016/j.forsciint.2014.07.017. [PMID: 25161162] - Guinevere H Bell, Andrew J Novak, William C Griffin, Kennerly S Patrick. Transdermal and oral dl-methylphenidate-ethanol interactions in C57BL/6J mice: transesterification to ethylphenidate and elevation of d-methylphenidate concentrations.
Journal of pharmaceutical sciences.
2011 Jul; 100(7):2966-78. doi:
10.1002/jps.22476. [PMID: 21240977] - Hao-Jie Zhu, Kennerly S Patrick, John S Markowitz. Enantiospecific determination of DL-methylphenidate and DL-ethylphenidate in plasma by liquid chromatography-tandem mass spectrometry: application to human ethanol interactions.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2011 Apr; 879(11-12):783-8. doi:
10.1016/j.jchromb.2011.02.033. [PMID: 21402502] - Kyle C Schmitt, Maarten E A Reith. The atypical stimulant and nootropic modafinil interacts with the dopamine transporter in a different manner than classical cocaine-like inhibitors.
PloS one.
2011; 6(10):e25790. doi:
10.1371/journal.pone.0025790. [PMID: 22043293] - K S Patrick, A B Straughn, R R Minhinnett, S D Yeatts, A E Herrin, C L DeVane, R Malcolm, G C Janis, J S Markowitz. Influence of ethanol and gender on methylphenidate pharmacokinetics and pharmacodynamics.
Clinical pharmacology and therapeutics.
2007 Mar; 81(3):346-53. doi:
10.1038/sj.clpt.6100082. [PMID: 17339864] - Robin L Williard, Lawrence D Middaugh, Hao-Jie B Zhu, Kennerly S Patrick. Methylphenidate and its ethanol transesterification metabolite ethylphenidate: brain disposition, monoamine transporters and motor activity.
Behavioural pharmacology.
2007 Feb; 18(1):39-51. doi:
10.1097/fbp.0b013e3280143226. [PMID: 17218796] - L F D van Vulpen, M M Malingré, R Lange, A K M Bartelink. [Sympathomimetic syndrome caused by autointoxication with methylphenidate].
Nederlands tijdschrift voor geneeskunde.
2006 Dec; 150(48):2661-4. doi:
NULL. [PMID: 17205945] - Kennerly S Patrick, Robin L Williard, Adam L VanWert, Justin J Dowd, John E Oatis, Lawrence D Middaugh. Synthesis and pharmacology of ethylphenidate enantiomers: the human transesterification metabolite of methylphenidate and ethanol.
Journal of medicinal chemistry.
2005 Apr; 48(8):2876-81. doi:
10.1021/jm0490989. [PMID: 15828826] - J S Markowitz, C L DeVane, D W Boulton, Z Nahas, S C Risch, F Diamond, K S Patrick. Ethylphenidate formation in human subjects after the administration of a single dose of methylphenidate and ethanol.
Drug metabolism and disposition: the biological fate of chemicals.
2000 Jun; 28(6):620-4. doi:
NULL. [PMID: 10820132] - B D Potts, C A Martin, M Vore. Gas-chromatographic quantification of methylphenidate in plasma with use of solid-phase extraction and nitrogen-sensitive detection.
Clinical chemistry.
1984 Aug; 30(8):1374-7. doi:
10.1093/clinchem/30.8.1374. [PMID: 6744589]