Propargyl alcohol (BioDeep_00000006024)
代谢物信息卡片
化学式: C3H4O (56.0262)
中文名称: 丙炔醇, 炔丙醇
谱图信息:
最多检出来源 Homo sapiens(lipidsearch) 49.82%
分子结构信息
SMILES: C#CCO
InChI: InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2
描述信息
A terminal acetylenic compound that is prop-2-yne substituted by a hydroxy group at position 1.
同义名列表
6 个代谢物同义名
Propargyl alcohol; prop-2-yn-1-ol; 2-Propyn-1-ol; Prop-2-yn-1-ol; Prop-2-yne-1-ol; Prop-2-in-1-ol; 1-Hydroxy-2-propyne; 1-Propyn-3-ol; 1-Propyn-3-yl alcohol; 2-Propynol; 2-Propynyl alcohol; 3-Hydroxy-1-propyne; 3-Propynol; Ethynylcarbinol; NA 1986; Propargyl alcohol; Propynyl alcohol; 2-Propyn-1-ol; 2-Propyn-1-ol; Propargyl alcohol
数据库引用编号
12 个数据库交叉引用编号
- ChEBI: CHEBI:28905
- KEGG: C05986
- PubChem: 7859
- Metlin: METLIN64617
- ChEMBL: CHEMBL1563026
- CAS: 107-19-7
- PMhub: MS000018950
- MetaboLights: MTBLC28905
- PubChem: 8264
- 3DMET: B00885
- NIKKAJI: J13B
- KNApSAcK: 28905
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
- Dijana Saftić, Biserka Žinić, Ljubica Glavaš-Obrovac, Mirosława Studzińska, Edyta Paradowska, Zbigniew J Leśnikowski. Synthesis and in vitro evaluation of antiviral and cytostatic properties of novel 8-triazolyl acyclovir derivatives.
Nucleosides, nucleotides & nucleic acids.
2018; 37(7):397-414. doi:
10.1080/15257770.2018.1485932. [PMID: 30449256] - Ru-Liang Xie, Tao Zhang, Ao-Cheng Cao, Xiang-Dong Mei. 4-(4-Chloro-5-methyl-3-trifluoro-meth-yl-1H-pyrazol-1-yl)-6-(prop-2-ynyl-oxy)pyrimidine.
Acta crystallographica. Section E, Structure reports online.
2010 Aug; 66(Pt 9):o2307. doi:
10.1107/s1600536810031740. [PMID: 21588656] - . Toxicology and carcinogenesis studies of propargyl alcohol (CAS No. 107-19-7) in F344/N rats and B6C3F1 mice (inhalation studies).
National Toxicology Program technical report series.
2008 Sep; ?(552):1-172. doi:
. [PMID: 18974778] - Sabine Bork, Naoaki Yokoyama, Tomohide Matsuo, Florencia G Claveria, Kozo Fujisaki, Ikuo Igarashi. Clotrimazole, ketoconazole, and clodinafop-propargyl as potent growth inhibitors of equine Babesia parasites during in vitro culture.
The Journal of parasitology.
2003 Jun; 89(3):604-6. doi:
10.1645/0022-3395(2003)089[0604:ckacap]2.0.co;2. [PMID: 12880264] - Ali R Banijamali, Vincent DeMatteo, Susan J Sumner. A mechanism for the formation of bis-glutathione conjugates of propargyl alcohol.
Pest management science.
2003 Mar; 59(3):331-8. doi:
10.1002/ps.641. [PMID: 12639051] - K J Dix, D P Coleman, J E Fossett, N F Gaudette, A P Stanley, B F Thomas, A R Jeffcoat. Disposition of propargyl alcohol in rat and mouse after intravenous, oral, dermal and inhalation exposure.
Xenobiotica; the fate of foreign compounds in biological systems.
2001 Jun; 31(6):357-75. doi:
10.1080/00498250110053228. [PMID: 11513248] - M Y Moridani, S Khan, T Chan, S Teng, K Beard, P J O'Brien. Cytochrome P450 2E1 metabolically activates propargyl alcohol: propiolaldehyde-induced hepatocyte cytotoxicity.
Chemico-biological interactions.
2001 Jan; 130-132(1-3):931-42. doi:
10.1016/s0009-2797(00)00246-5. [PMID: 11306107] - A R Banijamali, Y Xu, V DeMatteo, R J Strunk, S J Sumner. Identification of metabolites of [1,2,3-(13)C]Propargyl alcohol in mouse urine by (13)C NMR and mass spectrometry and comparison to rat.
Journal of agricultural and food chemistry.
2000 Oct; 48(10):4693-710. doi:
10.1021/jf000176k. [PMID: 11052721] - A R Banijamali, Y Xu, R J Strunk, M H Gay, M C Ellis, G J Putterman, S J Sumner. Identification of metabolites of [1,2,3-(13)C]Propargyl alcohol in rat urine by (13)C NMR and mass spectrometry.
Journal of agricultural and food chemistry.
1999 Apr; 47(4):1717-29. doi:
10.1021/jf980870o. [PMID: 10564044]
