Docosane (BioDeep_00000017672)

 

Secondary id: BioDeep_00000626184, BioDeep_00000860529

human metabolite PANOMIX_OTCML-2023


代谢物信息卡片


InChI=1/C22H46/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H

化学式: C22H46 (310.3599316)
中文名称: 二十二烷
谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 10.09%

分子结构信息

SMILES: CCCCCCCCCCCCCCCCCCCCCC
InChI: InChI=1S/C22H46/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3

描述信息

N-docosane, also known as ch3-[ch2]20-ch3 or dokosan, is a member of the class of compounds known as alkanes. Alkanes are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms. Thus, N-docosane is considered to be a hydrocarbon lipid molecule. N-docosane is an alkane and waxy tasting compound and can be found in a number of food items such as lemon balm, linden, allspice, and sunflower, which makes N-docosane a potential biomarker for the consumption of these food products. N-docosane can be found primarily in saliva. The term higher alkanes is sometimes used literally as "alkanes with a higher number of carbon atoms". One definition distinguishes the higher alkanes as the n-alkanes that are solid under natural conditions .
Docosane, also known as CH3-[CH2]20-CH3 or dokosan, belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms. Docosane is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Thus, docosane is considered to be a hydrocarbon lipid molecule. Docosane is an alkane and waxy tasting compound. Docosane is found, on average, in the highest concentration within lemon balms. Docosane has also been detected, but not quantified, in several different foods, such as allspices, lindens, papaya, and sunflowers. This could make docosane a potential biomarker for the consumption of these foods. A straight-chain alkane with 22 carbon atoms.
N-docosane is a solid. Insoluble in water. Used in organic synthesis, calibration, and temperature sensing equipment.
Docosane is a straight-chain alkane with 22 carbon atoms. It has a role as a plant metabolite.
Docosane is a natural product found in Lonicera japonica, Erucaria microcarpa, and other organisms with data available.
See also: Moringa oleifera leaf oil (part of).
A straight-chain alkane with 22 carbon atoms.
Docosane, a straight chain alkane, can be used to synthesize structural composites with thermal energy storage/release capability[1][2].
Docosane, a straight chain alkane, can be used to synthesize structural composites with thermal energy storage/release capability[1][2].

同义名列表

17 个代谢物同义名

InChI=1/C22H46/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H; ABD59C73-3CA6-4508-B950-18336DB59BE3; Docosane, analytical standard; Heneicosane, methyl-; CH3-(CH2)20-CH3; Normal-docosane; DOCOSANE [INCI]; UNII-OW99Q363KO; CH3-[CH2]20-CH3; Docosane, 99\\%; PARAFOL 22-95; Docosane, n-; OW99Q363KO; n-Docosane; Docosane; Dokosan; TWT



数据库引用编号

14 个数据库交叉引用编号

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)

68 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

  • Roghayeh Norouzi, Reza Abedi Maleki, Abolghasem Siyadatpanah, Alaa Fiad, Mohamed E El Zowalaty. In vitro scolicidal effect of Calendula officinalis, Artemisia dracunculus, Artemisia absinthium, and Ferula assafoetida extracts against hydatid cyst protoscolices. Annals of parasitology. 2022; 68(3):543-551. doi: 10.17420/ap6803.461. [PMID: 36587611]
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  • Huihui Zhao, Jianxin Chen, Qi Shi, Xueling Ma, Yi Yang, Liangtao Luo, Shuzhen Guo, Yong Wang, Jing Han, Wei Wang. Metabolomics-based study of clinical and animal plasma samples in coronary heart disease with blood stasis syndrome. Evidence-based complementary and alternative medicine : eCAM. 2012; 2012(?):638723. doi: 10.1155/2012/638723. [PMID: 22675387]
  • Ying Zhang, Yi Yuan, Baosong Cui, Shuai Li. [Study on chemical constituents from ethyl acetate extract of Myricaria bracteata]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2011 Apr; 36(8):1019-23. doi: . [PMID: 21809576]
  • Eva-Maria Krammer, Fabrice Homblé, Martine Prévost. Concentration dependent ion selectivity in VDAC: a molecular dynamics simulation study. PloS one. 2011; 6(12):e27994. doi: 10.1371/journal.pone.0027994. [PMID: 22164223]
  • Marco Pietroletti, Alfredo Capobianchi, Emanuela Ragosta, Mauro Mecozzi. Preliminary evaluation of hydrocarbon removal power of Caulerpa racemosa in seawater by means of infrared and visible spectroscopic measurements. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy. 2010 Oct; 77(3):673-9. doi: 10.1016/j.saa.2010.07.010. [PMID: 20692867]
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  • Anh N Hoang, Kanyile K Ncokazi, Katherine A de Villiers, David W Wright, Timothy J Egan. Crystallization of synthetic haemozoin (beta-haematin) nucleated at the surface of lipid particles. Dalton transactions (Cambridge, England : 2003). 2010 Feb; 39(5):1235-44. doi: 10.1039/b914359a. [PMID: 20104349]
  • Shahrokh Bagheri-Gavkosh, Mohsen Bigdeli, Masoomeh Shams-Ghahfarokhi, Mehdi Razzaghi-Abyaneh. Inhibitory effects of Ephedra major Host on Aspergillus parasiticus growth and aflatoxin production. Mycopathologia. 2009 Nov; 168(5):249-55. doi: 10.1007/s11046-009-9220-x. [PMID: 19557546]
  • Rehan Khan, Abdul Malik, Achyut Adhikari, Mohammad Irfan Qadir, Muhammad Iqbal Choudhary. Conferols A and B, new anti-inflammatory 4-hydroxyisoflavones from Caragana conferta. Chemical & pharmaceutical bulletin. 2009 Apr; 57(4):415-7. doi: 10.1248/cpb.57.415. [PMID: 19336940]
  • D Saïdana, M A Mahjoub, O Boussaada, J Chriaa, I Chéraif, M Daami, Z Mighri, A N Helal. Chemical composition and antimicrobial activity of volatile compounds of Tamarix boveana (Tamaricaceae). Microbiological research. 2008; 163(4):445-55. doi: 10.1016/j.micres.2006.07.009. [PMID: 17223327]
  • Mohammed K Azharuddin, Denis St J O'Reilly, Andrew Gray, Dinesh Talwar. HPLC method for plasma vitamin K1: effect of plasma triglyceride and acute-phase response on circulating concentrations. Clinical chemistry. 2007 Sep; 53(9):1706-13. doi: 10.1373/clinchem.2007.086280. [PMID: 17712007]
  • Cheryl Lans, Nancy Turner, Tonya Khan, Gerhard Brauer, Willi Boepple. Ethnoveterinary medicines used for ruminants in British Columbia, Canada. Journal of ethnobiology and ethnomedicine. 2007 Feb; 3(?):11. doi: 10.1186/1746-4269-3-11. [PMID: 17324258]
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  • Jin-Feng Lin, Chao-Feng Zhang, Mian Zhang, Zheng-Tao Wang. [Study on the chemical constituents in roots and rhizomes of Ligularia duciforms]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2005 Dec; 30(24):1927-9. doi: ". [PMID: 16494026]
  • Mikael Brosché, Basia Vinocur, Edward R Alatalo, Airi Lamminmäki, Thomas Teichmann, Eric A Ottow, Dimitar Djilianov, Dany Afif, Marie-Béatrice Bogeat-Triboulot, Arie Altman, Andrea Polle, Erwin Dreyer, Stephen Rudd, Lars Paulin, Petri Auvinen, Jaakko Kangasjärvi. Gene expression and metabolite profiling of Populus euphratica growing in the Negev desert. Genome biology. 2005; 6(12):R101. doi: 10.1186/gb-2005-6-12-r101. [PMID: 16356264]
  • Shi-feng Ni, Cheng-xin Fu, Yuan-jiang Pan, Yan-bin Lu, Ping Wu, Gilbert Y S Chan. [Contrastive analysis of volatile oil from Serissa serissoides in different seasons]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2004 Jan; 29(1):54-8. doi: . [PMID: 15709384]
  • Y J Wu, Y Y Cheng, S Zeng, M M Ma. Determination of dextromethorphan and its metabolite dextrorphan in human urine by capillary gas chromatography without derivatization. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences. 2003 Feb; 784(2):219-24. doi: 10.1016/s1570-0232(02)00797-3. [PMID: 12505769]
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