Cyclohexane (BioDeep_00001871676)
Main id: BioDeep_00000008561
代谢物信息卡片
cyclohexane
化学式: C6H12 (84.09389519999999)
中文名称: 环己烷
谱图信息:
最多检出来源 Homo sapiens(feces) 0.36%
Reviewed
Last reviewed on 2024-07-12.
Cite this Page
Cyclohexane. BioDeep Database v3. PANOMIX ltd, a top metabolomics service provider from China.
https://query.biodeep.cn/s/cyclohexane (retrieved
2024-09-20) (BioDeep RN: BioDeep_00001871676). Licensed
under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
分子结构信息
SMILES: c1ccccc1
InChI: InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2
描述信息
Cyclohexane appears as a clear colorless liquid with a petroleum-like odor. Used to make nylon, as a solvent, paint remover, and to make other chemicals. Flash point -4 °F. Density 6.5 lb / gal (less than water) and insoluble in water. Vapors heavier than air.
Cyclohexane is an alicyclic hydrocarbon comprising a ring of six carbon atoms; the cyclic form of hexane, used as a raw material in the manufacture of nylon. It has a role as a non-polar solvent. It is a cycloalkane and a volatile organic compound.
Cyclohexane is an organic compound with the molecular formula C6H12. It is a colorless, flammable liquid with a distinctive sweet odor. Cyclohexane is a saturated hydrocarbon, consisting of a six-membered ring of carbon atoms, with each carbon atom bonded to two hydrogen atoms. The carbon-carbon bonds in the ring are of equal length and angle, giving cyclohexane a regular, symmetrical structure.
Due to its ring structure, cyclohexane is more stable than the open-chain aliphatic hydrocarbons with the same number of carbon atoms. It is widely used in industry as a solvent for oils, waxes, and alkaloids, and as a starting material in the production of various chemicals, including adipic acid, cyclohexanol, and cyclohexene. Cyclohexane is also used in the manufacturing of nylon and other synthetic fibers.
Cyclohexane exhibits a unique conformational behavior, where it can exist in several different forms, known as conformers. The two most stable conformers are the chair form and the boat form. The chair conformation is the most stable and is characterized by alternating axial and equatorial hydrogen atoms, while the boat conformation has two pairs of hydrogen atoms that are close together, creating strain in the molecule.
In terms of its physical properties, cyclohexane has a boiling point of around 80.7°C and a melting point of approximately 6.47°C. It is relatively insoluble in water but miscible with many organic solvents. Cyclohexane is non-polar and therefore does not dissolve ionic compounds or highly polar molecules.
Cyclohexane. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=110-82-7 (retrieved 2024-07-12) (CAS RN: 110-82-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
同义名列表
1 个代谢物同义名
数据库引用编号
9 个数据库交叉引用编号
- ChEBI: CHEBI:29005
- KEGG: C11249
- PubChem: 8078
- ChEMBL: CHEMBL15980
- CAS: 110-82-7
- PubChem: 13426
- PDB-CCD: CHX
- NIKKAJI: J2.882G
- RefMet: Cyclohexane
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
- 54731 Nepeta racemosa: 10.1080/10412905.1993.9698205
- 29780 Mangifera indica: 10.1016/0031-9422(88)80124-9
- 155022 Terminalia chebula: 10.4103/0974-8490.112421
- 112363 Helichrysum odoratissimum: 10.1080/10412905.1993.9698235
- 31452 Plocamium cartilagineum: 10.1515/ZNC-2004-5-609
- 3741 Manilkara zapota: 10.1021/JF00111A026
- 54731 Nepeta racemosa: 10.1080/10412905.1993.9698205
- 29780 Mangifera indica: 10.1016/0031-9422(88)80124-9
- 155022 Terminalia chebula: 10.4103/0974-8490.112421
- 112363 Helichrysum odoratissimum: 10.1080/10412905.1993.9698235
- 31452 Plocamium cartilagineum: 10.1515/ZNC-2004-5-609
- 3741 Manilkara zapota: 10.1021/JF00111A026
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
- Yu-Yu Wang, Wei-Keng Luo, Song-Xiong Tang, Jun Xiang, Yao Dang, Bin Tang, Qi-Yuan Lu, Feng-Shan Cai, Ming-Zhong Ren, Yun-Jiang Yu, Jing Zheng. Bioaccumulation and biotransformation of 1,2-bis (2,4,6-tribromophenoxyethane) (BTBPE) and 1,2-dibromo-4-(1,2-dibromoethyl)-cyclohexane (TBECH) in zebrafish (Danio rerio).
Environmental pollution (Barking, Essex : 1987).
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Environmental toxicology.
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Tropical medicine & international health : TM & IH.
2012 Mar; 17(3):316-21. doi:
10.1111/j.1365-3156.2011.02922.x. [PMID: 22141406] - Ana C Stein, Alice F Viana, Liz G Müller, Jéssica M Nunes, Eveline D Stolz, Jean-Claude Do Rego, Jean Costentin, Gilsane L von Poser, Stela M K Rates. Uliginosin B, a phloroglucinol derivative from Hypericum polyanthemum: a promising new molecular pattern for the development of antidepressant drugs.
Behavioural brain research.
2012 Mar; 228(1):66-73. doi:
10.1016/j.bbr.2011.11.031. [PMID: 22155486] - Horst Karl, Jörg Oehlenschläger, Karen Bekaert, Jean-Pascal Bergé, Asli Cadun, Guillaume Duflos, Bianca Maria Poli, Margarita Tejada, Silvia Testi, Maike Timm-Heinrich. WEFTA interlaboratory comparison on total lipid determination in fishery products using the Smedes method.
Journal of AOAC International.
2012 Mar; 95(2):489-93. doi:
10.5740/jaoacint.11-041. [PMID: 22649936] - Lan Liu, Klaus Michelsen, Elena N Kitova, Paul D Schnier, John S Klassen. Energetics of lipid binding in a hydrophobic protein cavity.
Journal of the American Chemical Society.
2012 Feb; 134(6):3054-60. doi:
10.1021/ja208909n. [PMID: 22280480] - Wei Zhang, Radhia Benmohamed, Anthony C Arvanites, Richard I Morimoto, Robert J Ferrante, Donald R Kirsch, Richard B Silverman. Cyclohexane 1,3-diones and their inhibition of mutant SOD1-dependent protein aggregation and toxicity in PC12 cells.
Bioorganic & medicinal chemistry.
2012 Jan; 20(2):1029-45. doi:
10.1016/j.bmc.2011.11.039. [PMID: 22189273] - Helena Líbalová, Kateřina Uhlířová, Jiří Kléma, Miroslav Machala, Radim J Šrám, Miroslav Ciganek, Jan Topinka. Global gene expression changes in human embryonic lung fibroblasts induced by organic extracts from respirable air particles.
Particle and fibre toxicology.
2012 Jan; 9(?):1. doi:
10.1186/1743-8977-9-1. [PMID: 22239852] - Hyung Jin Kim, In-Seob Bae, Sang-Jin Cho, Jin-Hyo Boo, Byung-Cheo Lee, Jinhee Heo, Ilsub Chung, Byungyou Hong. Synthesis and characteristics of NH2-functionalized polymer films to align and immobilize DNA molecules.
Nanoscale research letters.
2012 Jan; 7(?):30. doi:
10.1186/1556-276x-7-30. [PMID: 22221314] - Imed Gargouri, Moncef Khadhraoui, Catherine Nisse, Ariane Leroyer, Mohamed Larbi Masmoudi, Boubaker Elleuch, Denis Zmirou-Navier. Occupational assessment of exposure to organic solvents in an adhesive producing company in Sfax, Tunisia.
Journal of occupational and environmental hygiene.
2012; 9(4):D71-6. doi:
10.1080/15459624.2012.666494. [PMID: 22469150] - Tokuma Fukuoka, Takashi Yanagihara, Seya Ito, Tomohiro Imura, Tomotake Morita, Hideki Sakai, Masahiko Abe, Dai Kitamoto. Reverse vesicle formation from the yeast glycolipid biosurfactant mannosylerythritol lipid-D.
Journal of oleo science.
2012; 61(5):285-9. doi:
10.5650/jos.61.285. [PMID: 22531056] - HaiKuan Wang, YanHua Yan, JiaMing Wang, HePing Zhang, Wei Qi. Production and characterization of antifungal compounds produced by Lactobacillus plantarum IMAU10014.
PloS one.
2012; 7(1):e29452. doi:
10.1371/journal.pone.0029452. [PMID: 22276116] - Ygor Lucena Cabral de Oliveira, Luís Cláudio Nascimento da Silva, Alexandre Gomes da Silva, Alexandre José Macedo, Janete Magali de Araújo, Maria Tereza dos Santos Correia, Márcia Vanusa da Silva. Antimicrobial activity and phytochemical screening of Buchenavia tetraphylla (Aubl.) R. A. Howard (Combretaceae: Combretoideae).
TheScientificWorldJournal.
2012; 2012(?):849302. doi:
10.1100/2012/849302. [PMID: 23365533] - Bhavapriya Vaitheesvaran, Li Yang, Kirsten Hartil, Sherrye Glaser, Stephen Yazulla, James E Bruce, Irwin J Kurland. Peripheral effects of FAAH deficiency on fuel and energy homeostasis: role of dysregulated lysine acetylation.
PloS one.
2012; 7(3):e33717. doi:
10.1371/journal.pone.0033717. [PMID: 22442717] - Gavin Tansley, Daniel T Holmes, Dieter Lütjohann, Elizabeth Head, Cheryl L Wellington. Sterol lipid metabolism in down syndrome revisited: down syndrome is associated with a selective reduction in serum brassicasterol levels.
Current gerontology and geriatrics research.
2012; 2012(?):179318. doi:
10.1155/2012/179318. [PMID: 22649448] - Weng Ieong Tou, Calvin Yu-Chian Chen. In silico investigation of potential SRC kinase ligands from traditional Chinese medicine.
PloS one.
2012; 7(3):e33728. doi:
10.1371/journal.pone.0033728. [PMID: 22470466] - Carmony L Hartwig, Erica M W Lauterwasser, Sumit S Mahajan, Jonathan M Hoke, Roland A Cooper, Adam R Renslo. Investigating the antimalarial action of 1,2,4-trioxolanes with fluorescent chemical probes.
Journal of medicinal chemistry.
2011 Dec; 54(23):8207-13. doi:
10.1021/jm2012003. [PMID: 22023506] - Soo-Jung Lee, Myung-Hee Kang, Hyesun Min. Folic acid supplementation reduces oxidative stress and hepatic toxicity in rats treated chronically with ethanol.
Nutrition research and practice.
2011 Dec; 5(6):520-6. doi:
10.4162/nrp.2011.5.6.520. [PMID: 22259676] - Imed Gargouri, Moncef Khadhraoui, Catherine Nisse, Ariane Leroyer, Mohamed L Masmoudi, Paul Frimat, Daniel Marzin, Boubaker Elleuch, Denis Zmirou-Navier. A case study on co-exposure to a mixture of organic solvents in a Tunisian adhesive-producing company.
Journal of occupational medicine and toxicology (London, England).
2011 Nov; 6(?):28. doi:
10.1186/1745-6673-6-28. [PMID: 22082240] - Adebayo Lamikanra, Jennifer L Crowe, Rebeccah S Lijek, Babatunde W Odetoyin, John Wain, A Oladipo Aboderin, Iruka N Okeke. Rapid evolution of fluoroquinolone-resistant Escherichia coli in Nigeria is temporally associated with fluoroquinolone use.
BMC infectious diseases.
2011 Nov; 11(?):312. doi:
10.1186/1471-2334-11-312. [PMID: 22060770] - Ingrid Elisia, David D Kitts. Quantification of hexanal as an index of lipid oxidation in human milk and association with antioxidant components.
Journal of clinical biochemistry and nutrition.
2011 Nov; 49(3):147-52. doi:
10.3164/jcbn.10-142. [PMID: 22128211] - Damien Lacroix, Soizic Prado, Dennis Kamoga, John Kasenene, Bernard Bodo. Structure and in vitro antiparasitic activity of constituents of Citropsis articulata root bark.
Journal of natural products.
2011 Oct; 74(10):2286-9. doi:
10.1021/np2004825. [PMID: 21985060] - Lukasz Cwiklik, Adelia J A Aquino, Mario Vazdar, Piotr Jurkiewicz, Jiří Pittner, Martin Hof, Hans Lischka. Absorption and fluorescence of PRODAN in phospholipid bilayers: a combined quantum mechanics and classical molecular dynamics study.
The journal of physical chemistry. A.
2011 Oct; 115(41):11428-37. doi:
10.1021/jp205966b. [PMID: 21910413] - Ariane Wohlfarth, Hellmut Mahler, Volker Auwärter. Rapid isolation procedure for Δ9-tetrahydrocannabinolic acid A (THCA) from Cannabis sativa using two flash chromatography systems.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2011 Oct; 879(28):3059-64. doi:
10.1016/j.jchromb.2011.09.012. [PMID: 21944900] - John V W Becker, Marina M van der Merwe, Anna C van Brummelen, Pamisha Pillay, Bridget G Crampton, Edwin M Mmutlane, Chris Parkinson, Fanie R van Heerden, Neil R Crouch, Peter J Smith, Dalu T Mancama, Vinesh J Maharaj. In vitro anti-plasmodial activity of Dicoma anomala subsp. gerrardii (Asteraceae): identification of its main active constituent, structure-activity relationship studies and gene expression profiling.
Malaria journal.
2011 Oct; 10(?):295. doi:
10.1186/1475-2875-10-295. [PMID: 21985233] - Binita Dutta, Moumita Maiti, Susanta Lahiri. Production and separation of no-carrier-added thallium isotopes from proton irradiated (nat)Hg₂Cl₂ matrix.
Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine.
2011 Oct; 69(10):1337-42. doi:
10.1016/j.apradiso.2011.05.016. [PMID: 21646027] - Sebastian Peter, Matthias Kinne, Xiaoshi Wang, René Ullrich, Gernot Kayser, John T Groves, Martin Hofrichter. Selective hydroxylation of alkanes by an extracellular fungal peroxygenase.
The FEBS journal.
2011 Oct; 278(19):3667-75. doi:
10.1111/j.1742-4658.2011.08285.x. [PMID: 21812933] - Mei Fen Shih, Min Da Shau, Cheng Chih Hsieh, Jong Yuh Cherng. Synthesis and evaluation of poly(hexamethylene-urethane) and PEG-poly(hexamethylene-urethane) and their cholesteryl oleyl carbonate composites for human blood biocompatibility.
Molecules (Basel, Switzerland).
2011 Sep; 16(10):8181-97. doi:
10.3390/molecules16108181. [PMID: 21959293] - Madiha Dhibi, Faten Brahmi, Amira Mnari, Zohra Houas, Issam Chargui, Linda Bchir, Noureddine Gazzah, Mohammed A Alsaif, Mohamed Hammami. The intake of high fat diet with different trans fatty acid levels differentially induces oxidative stress and non alcoholic fatty liver disease (NAFLD) in rats.
Nutrition & metabolism.
2011 Sep; 8(1):65. doi:
10.1186/1743-7075-8-65. [PMID: 21943357] - Motoko Shintani, Gen Takahashi, Masakazu Hamada, Shyusuke Okunaga, Soichi Iwai, Yoshiaki Yura. Effect of ultrasound on herpes simplex virus infection in cell culture.
Virology journal.
2011 Sep; 8(?):446. doi:
10.1186/1743-422x-8-446. [PMID: 21939524] - Krzysztof Zienkiewicz, Agnieszka Zienkiewicz, María Isabel Rodríguez-García, Antonio J Castro. Characterization of a caleosin expressed during olive (Olea europaea L.) pollen ontogeny.
BMC plant biology.
2011 Aug; 11(?):122. doi:
10.1186/1471-2229-11-122. [PMID: 21884593] - Justin L MacCallum, W F Drew Bennett, D Peter Tieleman. Transfer of arginine into lipid bilayers is nonadditive.
Biophysical journal.
2011 Jul; 101(1):110-7. doi:
10.1016/j.bpj.2011.05.038. [PMID: 21723820] - Bertrand Boson, Ophélia Granio, Ralf Bartenschlager, François-Loïc Cosset. A concerted action of hepatitis C virus p7 and nonstructural protein 2 regulates core localization at the endoplasmic reticulum and virus assembly.
PLoS pathogens.
2011 Jul; 7(7):e1002144. doi:
10.1371/journal.ppat.1002144. [PMID: 21814513] - Yiguang Jin, Rui Xin, Li Tong, Lina Du, Miao Li. Combination anti-HIV therapy with the self-assemblies of an asymmetric bolaamphiphilic zidovudine/didanosine prodrug.
Molecular pharmaceutics.
2011 Jun; 8(3):867-76. doi:
10.1021/mp100457d. [PMID: 21553876] - Dennis Verzijl, Ad P Ijzerman. Functional selectivity of adenosine receptor ligands.
Purinergic signalling.
2011 Jun; 7(2):171-92. doi:
10.1007/s11302-011-9232-0. [PMID: 21544511] - Diego Colombo, Cristina Tringali, Laura Franchini, Federica Cirillo, Bruno Venerando. Glycoglycerolipid analogues inhibit PKC translocation to the plasma membrane and downstream signaling pathways in PMA-treated fibroblasts and human glioblastoma cells, U87MG.
European journal of medicinal chemistry.
2011 May; 46(5):1827-34. doi:
10.1016/j.ejmech.2011.02.043. [PMID: 21388717] - Jing Ruan, Kan Wang, Hua Song, Xin Xu, Jiajia Ji, Daxiang Cui. Biocompatibility of hydrophilic silica-coated CdTe quantum dots and magnetic nanoparticles.
Nanoscale research letters.
2011 Apr; 6(1):299. doi:
10.1186/1556-276x-6-299. [PMID: 21711857] - Karim Engelmark Cassimjee, Robert Kourist, Diana Lindberg, Marianne Wittrup Larsen, Nguyen Hong Thanh, Mikael Widersten, Uwe T Bornscheuer, Per Berglund. One-step enzyme extraction and immobilization for biocatalysis applications.
Biotechnology journal.
2011 Apr; 6(4):463-9. doi:
10.1002/biot.201000357. [PMID: 21381205] - S Sadish Kumar, Y Kumar, M S Y Khan, J Anbu, E De Clercq. Antihistaminic and antiviral activities of steroids of Turbinaria conoides.
Natural product research.
2011 Apr; 25(7):723-9. doi:
10.1080/14786411003781515. [PMID: 21462071] - Lygia T Budnik, Dennis Nowak, Rolf Merget, Catherine Lemiere, Xaver Baur. Elimination kinetics of diisocyanates after specific inhalative challenges in humans: mass spectrometry analysis, as a basis for biomonitoring strategies.
Journal of occupational medicine and toxicology (London, England).
2011 Mar; 6(1):9. doi:
10.1186/1745-6673-6-9. [PMID: 21447151] - Adam V Wisnewski, Lan Xu, Eve Robinson, Jian Liu, Carrie A Redlich, Christina A Herrick. Immune sensitization to methylene diphenyl diisocyanate (MDI) resulting from skin exposure: albumin as a carrier protein connecting skin exposure to subsequent respiratory responses.
Journal of occupational medicine and toxicology (London, England).
2011 Mar; 6(?):6. doi:
10.1186/1745-6673-6-6. [PMID: 21414210] - Shuanglian Li, Ying Chen, Shuzhong Zhang, Swati S More, Xiaozhu Huang, Kathleen M Giacomini. Role of organic cation transporter 1, OCT1 in the pharmacokinetics and toxicity of cis-diammine(pyridine)chloroplatinum(II) and oxaliplatin in mice.
Pharmaceutical research.
2011 Mar; 28(3):610-25. doi:
10.1007/s11095-010-0312-6. [PMID: 21104302] - Claudia Kühn, Niki Eliza Arapogianni, Maria Halabalaki, Jana Hempel, Nicole Hunger, Jannette Wober, Alexios Leandros Skaltsounis, Günter Vollmer. Constituents from Cistus salvifolius (Cistaceae) activate peroxisome proliferator-activated receptor-γ but not -δ and stimulate glucose uptake by adipocytes.
Planta medica.
2011 Mar; 77(4):346-53. doi:
10.1055/s-0030-1250382. [PMID: 20922652] - Babiker El-Haj, Abdulkader Al-Amri, Heyam Saad Ali. Target urinary analytes for the gas chromatographic- mass spectrometric detection of procyclidine and benzhexol in drug abuse cases.
Journal of analytical toxicology.
2011 Mar; 35(2):92-8. doi:
10.1093/anatox/35.2.92. [PMID: 21396228] - Luke Chimuka, Manuela van Pinxteren, Johan Billing, Ecevit Yilmaz, Jan Åke Jönsson. Selective extraction of triazine herbicides based on a combination of membrane assisted solvent extraction and molecularly imprinted solid phase extraction.
Journal of chromatography. A.
2011 Feb; 1218(5):647-53. doi:
10.1016/j.chroma.2010.12.019. [PMID: 21190688] - Seul Hee Lee, Zachary R Dilworth, Erik Hsiao, Anna L Barnette, Matthew Marino, Jeong Hoon Kim, Jung-Gu Kang, Tae-Hwan Jung, Seong H Kim. One-step production of superhydrophobic coatings on flat substrates via atmospheric Rf plasma process using non-fluorinated hydrocarbons.
ACS applied materials & interfaces.
2011 Feb; 3(2):476-81. doi:
10.1021/am101052z. [PMID: 21280582] - Tom H Johnston, Philippe Huot, Susan H Fox, James D Wakefield, Kristine A Sykes, Wilmin P Bartolini, G Todd Milne, James P Pearson, Jonathan M Brotchie. Fatty acid amide hydrolase (FAAH) inhibition reduces L-3,4-dihydroxyphenylalanine-induced hyperactivity in the 1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine-lesioned non-human primate model of Parkinson's disease.
The Journal of pharmacology and experimental therapeutics.
2011 Feb; 336(2):423-30. doi:
10.1124/jpet.110.169532. [PMID: 20966038] - Hadil F Al-Jallad, Vamsee D Myneni, Sarah A Piercy-Kotb, Nicolas Chabot, Amina Mulani, Jeffrey W Keillor, Mari T Kaartinen. Plasma membrane factor XIIIA transglutaminase activity regulates osteoblast matrix secretion and deposition by affecting microtubule dynamics.
PloS one.
2011 Jan; 6(1):e15893. doi:
10.1371/journal.pone.0015893. [PMID: 21283799]