N-Methylphenethylamine (BioDeep_00000228127)
Main id: BioDeep_00000017461
human metabolite PANOMIX_OTCML-2023 Volatile Flavor Compounds
代谢物信息卡片
化学式: C9H13N (135.1047938)
中文名称: N-甲基-2-苯乙胺, N-甲基苯乙胺
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: c1cccc(c1)CCNC
InChI: InChI=1S/C9H13N/c1-10-8-7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
描述信息
N-methylphenethylamine, also known as N-methylphenethylamine hydrochloride or N-methylphenethylamine, conjugate acid, is a member of the class of compounds known as phenethylamines. Phenethylamines are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine. N-methylphenethylamine is slightly soluble (in water) and a very strong basic compound (based on its pKa). N-methylphenethylamine can be found in a number of food items such as apple, white cabbage, carrot, and cabbage, which makes N-methylphenethylamine a potential biomarker for the consumption of these food products. N-Methylphenethylamine (NMPEA) is a naturally occurring trace amine neuromodulator in humans that is derived from the trace amine, phenethylamine (PEA). It has been detected in human urine (<1 μg over 24 hours) and is produced by phenylethanolamine N-methyltransferase with phenethylamine as a substrate. PEA and NMPEA are both alkaloids that are found in a number of different plant species as well. Some Acacia species, such as A. rigidula, contain remarkably high levels of NMPEA (~2300–5300 ppm). NMPEA is also present at low concentrations (< 10 ppm) in a wide range of foodstuffs .
N-methylphenethylamine, also known as N-methylphenethylamine hydrochloride or N-methylphenethylamine, conjugate acid, is a member of the class of compounds known as phenethylamines. Phenethylamines are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine. N-methylphenethylamine is slightly soluble (in water) and a very strong basic compound (based on its pKa). N-methylphenethylamine can be found in a number of food items such as apple, white cabbage, carrot, and cabbage, which makes N-methylphenethylamine a potential biomarker for the consumption of these food products. N-Methylphenethylamine (NMPEA) is a naturally occurring trace amine neuromodulator in humans that is derived from the trace amine, phenethylamine (PEA). It has been detected in human urine (<1 μg over 24 hours) and is produced by phenylethanolamine N-methyltransferase with phenethylamine as a substrate. PEA and NMPEA are both alkaloids that are found in a number of different plant species as well. Some Acacia species, such as A. rigidula, contain remarkably high levels of NMPEA (~2300–5300 ppm). NMPEA is also present at low concentrations (< 10 ppm) in a wide range of foodstuffs .
同义名列表
11 个代谢物同义名
N-methylphenethylamine, conjugate acid; N-methylphenethylamine hydrochloride; N-methylphenethylamine sodium; N-methyl-beta-phenethylamine; N-methyl-2-phenylethanamine; Methyl(2-Phenylethyl)Amine; n-methylphenylethylamine; N-Methylphenethylamine; Methyl-phenethyl-amine; methylphenethylamine; N-Methylphenethylamine
数据库引用编号
8 个数据库交叉引用编号
- PubChem: 11503
- HMDB: HMDB0303319
- ChEMBL: CHEMBL45763
- KNApSAcK: C00042776
- foodb: FDB010581
- chemspider: 11019
- CAS: 589-08-2
- RefMet: N-Methylphenethylamine
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)
12 个相关的物种来源信息
- 1378370 - Acacia kettlewelliae: 10.2307/4117899
- 468212 - Acaciella angustissima: 10.2307/4117899
- 47037 - Alhagi maurorum:
- 54874 - Gleditsia triacanthos: 10.2307/4117899
- 9606 - Homo sapiens: -
- 138013 - Senegalia berlandieri: 10.1016/S0031-9422(97)00240-9
- 247878 - Senegalia greggii: 10.2307/4117899
- 199151 - Senegalia roemeriana: 10.2307/4117899
- 1789066 - Senna marilandica: 10.2307/4117899
- 138020 - Vachellia constricta: 10.2307/4117899
- 205076 - Vachellia rigidula:
- 138042 - Vachellia schottii: 10.2307/4117899
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
- Piotr Chołbiński, Mariola Wicka, Katarzyna Kowalczyk, Anna Jarek, Paweł Kaliszewski, Andrzej Pokrywka, Ewa Bulska, Dorota Kwiatkowska. Detection of β-methylphenethylamine, a novel doping substance, by means of UPLC/MS/MS.
Analytical and bioanalytical chemistry.
2014 Jun; 406(15):3681-8. doi:
10.1007/s00216-014-7728-5
. [PMID: 24633566] - T D Forbes, B B Carpenter, R D Randel, D R Tolleson. Effects of phenolic monoamines on release of luteinizing hormone stimulated by gonadotropin-releasing hormone and on plasma adrenocorticotropic hormone, norepinephrine, and cortisol concentrations in wethers.
Journal of animal science.
1994 Feb; 72(2):464-9. doi:
10.2527/1994.722464x
. [PMID: 8157532] - J D Duncan, G Hallström, U Paulsen-Sörman, B Lindeke, A K Cho. Effects of alpha-carbon substituents on the N-demethylation of N-methyl-2-phenethylamines by rat liver microsomes.
Drug metabolism and disposition: the biological fate of chemicals.
1983 Jan; 11(1):15-20. doi:
"
. [PMID: 6132789] - H E Shannon, E J Cone, D Yousefnejad. Physiologic effects and plasma kinetics of beta-phenylethylamine and its N-methyl homolog in the dog.
The Journal of pharmacology and experimental therapeutics.
1982 Oct; 223(1):190-6. doi:
. [PMID: 7120117]