Creosol (BioDeep_00000617458)

Main id: BioDeep_00000026386

 

PANOMIX_OTCML-2023 natural product


代谢物信息卡片


InChI=1\C8H10O2\c1-6-3-4-7(9)8(5-6)10-2\h3-5,9H,1-2H

化学式: C8H10O2 (138.06807600000002)
中文名称: 2-甲氧基-4-甲基苯酚
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1=CC(=C(C=C1)O)OC
InChI: InChI=1S/C8H10O2/c1-6-3-4-7(9)8(5-6)10-2/h3-5,9H,1-2H3

描述信息

C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent
Creosol is an endogenous metabolite.
Creosol is an endogenous metabolite.

同义名列表

51 个代谢物同义名

2-METHOXY-4-METHYLPHENOL; Creosol; InChI=1\C8H10O2\c1-6-3-4-7(9)8(5-6)10-2\h3-5,9H,1-2H; 4-06-00-05878 (Beilstein Handbook Reference); 1-Hydroxy-2-methoxy-4-methylbenzene; 4-Hydroxy-3-methoxy-1-methylbenzene; Homocatechol monomethyl ether; Phenol, 3-methoxy-4-methyl-; Phenol, 2-methoxy-4-methyl-; 4-Hydroxy-3-methoxytoluene; 3-Methoxy-4-hydroxytoluene; 2-Methoxy-4-methyl-phenol; 2-Hydroxy-5-methylanisole; 4-Methyl-2-methoxyphenol; p-Cresol, 2-methoxy-; 2-Methoxy-4-cresol; 2-Methoxy-P-cresol; 4-Methyl guaiacol; Kreosol [German]; 4-Methylguaiacol; P-Methylguaiacol; EINECS 202-252-9; Cresolum drudum; W267112_ALDRICH; W267104_ALDRICH; 302880_ALDRICH; FEMA No. 2671; Homoguaiacol; ZINC03875629; BRN 1862340; 65088_FLUKA; P-Creosol; SBB008258; AI3-15891; Rohkcrsol; NSC 4969; 93-51-6; NSC4969; FR-1124; 2-Methoxy-4-methylphenol (4-methylguaiacol); 4-Methyl-2-methoxyphenol (4-methylguaiacol); 2-Methoxy-4-methylphenol (creosol); 2-Methoxy-4-methylphenol, 9ci; Phenol, 4-methyl-2-methoxy; 3-Methoxy-4-methyl-phenol; Homocatechol methyl ester; 5-Methylguaiacol; P-Methylguaicol; FEMA 2671; Valspice; Kreosol



数据库引用编号

7 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)

31 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

  • Hongyu Rao, Peibo Li, Hao Wu, Chong Liu, Wei Peng, Weiwei Su. Simultaneous Determination of Six Compounds in Destructive Distillation Extracts of Hawthorn Seed by GC-MS and Evaluation of Their Antimicrobial Activity. Molecules (Basel, Switzerland). 2019 Nov; 24(23):. doi: 10.3390/molecules24234328. [PMID: 31783502]
  • Christel Brunschwig, Sophie Rochard, Alexandre Pierrat, Anne Rouger, Perrine Senger-Emonnot, Gérard George, Phila Raharivelomanana. Volatile composition and sensory properties of Vanilla × tahitensis bring new insights for vanilla quality control. Journal of the science of food and agriculture. 2016 Feb; 96(3):848-58. doi: 10.1002/jsfa.7157. [PMID: 25754309]
  • Annelies Breynaert, Douwina Bosscher, Ariane Kahnt, Magda Claeys, Paul Cos, Luc Pieters, Nina Hermans. Development and Validation of an in vitro Experimental GastroIntestinal Dialysis Model with Colon Phase to Study the Availability and Colonic Metabolisation of Polyphenolic Compounds. Planta medica. 2015 Aug; 81(12-13):1075-83. doi: 10.1055/s-0035-1546154. [PMID: 26166134]
  • M N Gallucci, M E Carezzano, M M Oliva, M S Demo, R P Pizzolitto, M P Zunino, J A Zygadlo, J S Dambolena. In vitro activity of natural phenolic compounds against fluconazole-resistant Candida species: a quantitative structure-activity relationship analysis. Journal of applied microbiology. 2014 Apr; 116(4):795-804. doi: 10.1111/jam.12432. [PMID: 24387763]
  • Martin Zabka, Roman Pavela. Antifungal efficacy of some natural phenolic compounds against significant pathogenic and toxinogenic filamentous fungi. Chemosphere. 2013 Oct; 93(6):1051-6. doi: 10.1016/j.chemosphere.2013.05.076. [PMID: 23800587]
  • David Kelly, Ayalsew Zerihun, Davinder P Singh, Christiane Vitzthum von Eckstaedt, Mark Gibberd, Kliti Grice, Mark Downey. Exposure of grapes to smoke of vegetation with varying lignin composition and accretion of lignin derived putative smoke taint compounds in wine. Food chemistry. 2012 Nov; 135(2):787-98. doi: 10.1016/j.foodchem.2012.05.036. [PMID: 22868160]
  • Michael D Sharp, Nurdan A Kocaoglu-Vurma, Vaughan Langford, Luis E Rodriguez-Saona, W James Harper. Rapid discrimination and characterization of vanilla bean extracts by attenuated total reflection infrared spectroscopy and selected ion flow tube mass spectrometry. Journal of food science. 2012 Mar; 77(3):C284-92. doi: 10.1111/j.1750-3841.2011.02544.x. [PMID: 22384952]
  • Venugopal Mendu, Anne E Harman-Ware, Mark Crocker, Jungho Jae, Jozsef Stork, Samuel Morton, Andrew Placido, George Huber, Seth Debolt. Identification and thermochemical analysis of high-lignin feedstocks for biofuel and biochemical production. Biotechnology for biofuels. 2011 Oct; 4(?):43. doi: 10.1186/1754-6834-4-43. [PMID: 22018114]
  • Betty Mbatia, Shiva Shanker Kaki, Bo Mattiasson, Francis Mulaa, Patrick Adlercreutz. Enzymatic synthesis of lipophilic rutin and vanillyl esters from fish byproducts. Journal of agricultural and food chemistry. 2011 Jul; 59(13):7021-7. doi: 10.1021/jf200867r. [PMID: 21630661]
  • Grazyna Bieniek, Krystyna Stepien. Occupational exposure to phenolic compounds at coke plants--urinary excretion of methoxyphenols as an indicator of exposure to methoxyphenols. Journal of occupational health. 2011; 53(2):110-4. doi: 10.1539/joh.o10005. [PMID: 21245652]
  • Joni Macdonald, James D Glover, Lorna Taylor, Helen M Sang, Michael J McGrew. Characterisation and germline transmission of cultured avian primordial germ cells. PloS one. 2010 Nov; 5(11):e15518. doi: 10.1371/journal.pone.0015518. [PMID: 21124737]
  • Igor Jerković, Gordana Hegić, Zvonimir Marijanović, Dragan Bubalo. Organic extractives from Mentha spp. honey and the bee-stomach: methyl syringate, vomifoliol, terpenediol I, hotrienol and other compounds. Molecules (Basel, Switzerland). 2010 Apr; 15(4):2911-24. doi: 10.3390/molecules15042911. [PMID: 20428087]
  • Yoshiaki Shirai, Satoko Ueno, Akira Nakayama, Kiyoko Ikeuchi, Kazuyuki Ubukata, Ryuichi Mihara, Bruce K Bernard. Studies of the toxicological potential of capsinoids, XII: pharmacokinetic study of capsinoid-containing CH-19 Sweet extract in rats. International journal of toxicology. 2010 Mar; 29(2 Suppl):15S-21S. doi: 10.1177/1091581809359427. [PMID: 20388820]
  • Enrico Cappellini, M Thomas P Gilbert, Filippo Geuna, Girolamo Fiorentino, Allan Hall, Jane Thomas-Oates, Peter D Ashton, David A Ashford, Paul Arthur, Paula F Campos, Johan Kool, Eske Willerslev, Matthew J Collins. A multidisciplinary study of archaeological grape seeds. Die Naturwissenschaften. 2010 Feb; 97(2):205-17. doi: 10.1007/s00114-009-0629-3. [PMID: 20033124]
  • Juliana Alencar, Gaëlle Gosset, Maxime Robin, Valérie Pique, Marcel Culcasi, Jean-Louis Clément, Anne Mercier, Sylvia Pietri. Improving the stability and antioxidant properties of sesame oil: water-soluble spray-dried emulsions from new transesterified phenolic derivatives. Journal of agricultural and food chemistry. 2009 Aug; 57(16):7311-23. doi: 10.1021/jf9010627. [PMID: 19653627]
  • Antonella Rosa, Giovanni Appendino, M Paola Melis, Monica Deiana, Angela Atzeri, Incani Alessandra, Alberto Minassi, M Assunta Dessì. Protective effect and relation structure-activity of nonivamide and iododerivatives in several models of lipid oxidation. Chemico-biological interactions. 2009 Jul; 180(2):183-92. doi: 10.1016/j.cbi.2009.01.002. [PMID: 19497416]
  • Hyun-Kyung Choi, Sun Choi, Yoonji Lee, Dong Wook Kang, HyungChul Ryu, Han-Joo Maeng, Suk-Jae Chung, Vladimir A Pavlyukovets, Larry V Pearce, Attila Toth, Richard Tran, Yun Wang, Matthew A Morgan, Peter M Blumberg, Jeewoo Lee. Non-vanillyl resiniferatoxin analogues as potent and metabolically stable transient receptor potential vanilloid 1 agonists. Bioorganic & medicinal chemistry. 2009 Jan; 17(2):690-8. doi: 10.1016/j.bmc.2008.11.085. [PMID: 19135377]
  • Pei Sun Loh, Axel E J Miller, Alison D Reeves, S Martyn Harvey, Julian Overnell. Optimised recovery of lignin-derived phenols in a Scottish fjord by the CuO oxidation method. Journal of environmental monitoring : JEM. 2008 Oct; 10(10):1187-94. doi: 10.1039/b808970a. [PMID: 19244642]
  • Joris Vriens, Bernd Nilius, Rudi Vennekens. Herbal compounds and toxins modulating TRP channels. Current neuropharmacology. 2008 Mar; 6(1):79-96. doi: 10.2174/157015908783769644. [PMID: 19305789]
  • Jing Zhang, Bao-yuan Chen, Jin-ying Han, Jie Cao, Mei-nan Guo, Yan Wang. [Role of sympathetic nerve activity and arterial endothelial function in pathogenesis of hypertension in patients with obstructive sleep apnea-hypopnea syndrome]. Zhonghua jie he he hu xi za zhi = Zhonghua jiehe he huxi zazhi = Chinese journal of tuberculosis and respiratory diseases. 2007 Jun; 30(6):437-41. doi: NULL. [PMID: 17673017]
  • S Mihok, D A Carlson, P N Ndegwa. Tsetse and other biting fly responses to Nzi traps baited with octenol, phenols and acetone. Medical and veterinary entomology. 2007 Mar; 21(1):70-84. doi: 10.1111/j.1365-2915.2007.00665.x. [PMID: 17373949]
  • Daniel Gilbert, Katharina Funk, Brigitte Dekowski, Ralf Lechler, Sandro Keller, Frank Möhrlen, Stephan Frings, Volker Hagen. Caged capsaicins: New tools for the examination of TRPV1 channels in somatosensory neurons. Chembiochem : a European journal of chemical biology. 2007 Jan; 8(1):89-97. doi: 10.1002/cbic.200600437. [PMID: 17154194]
  • . Final report on the safety assessment of capsicum annuum extract, capsicum annuum fruit extract, capsicum annuum resin, capsicum annuum fruit powder, capsicum frutescens fruit, capsicum frutescens fruit extract, capsicum frutescens resin, and capsaicin. International journal of toxicology. 2007; 26 Suppl 1(?):3-106. doi: 10.1080/10915810601163939. [PMID: 17365137]
  • Ana-Lilia González-Yebra, Carlos Kornhauser, Kazimierz Wrobel, Elva-Leticia Pérez-Luque, Katarzina Wrobel, Gloria Barbosa. Occupational exposure to toluene and its possible causative role in renal damage development in shoe workers. International archives of occupational and environmental health. 2006 Mar; 79(3):259-64. doi: 10.1007/s00420-005-0001-7. [PMID: 16001213]
  • Shan-Shan Yao, Wen-Fei Guo, Yi Lu, Yuan-Xun Jiang. Flavor characteristics of lapsang souchong and smoked lapsang souchong, a special Chinese black tea with pine smoking process. Journal of agricultural and food chemistry. 2005 Nov; 53(22):8688-93. doi: 10.1021/jf058059i. [PMID: 16248572]
  • Tsutomu Warashina, Yoshimi Nagatani, Tadataka Noro. Constituents from the bark of Tabebuia impetiginosa. Phytochemistry. 2004 Jul; 65(13):2003-11. doi: 10.1016/j.phytochem.2004.06.012. [PMID: 15280007]
  • Alan P Pollnitz, Kevin H Pardon, Michael Sykes, Mark A Sefton. The effects of sample preparation and gas chromatograph injection techniques on the accuracy of measuring guaiacol, 4-methylguaiacol and other volatile oak compounds in oak extracts by stable isotope dilution analyses. Journal of agricultural and food chemistry. 2004 Jun; 52(11):3244-52. doi: 10.1021/jf035380x. [PMID: 15161177]
  • Grant T McQuate, Young Soo Keum, Charmaine D Sylva, Qing X Li, Eric B Jang. Active ingredients in cade oil that synergize attractiveness of alpha-ionol to male Bactrocera latifrons (Diptera: Tephritidae). Journal of economic entomology. 2004 Jun; 97(3):862-70. doi: 10.1603/0022-0493(2004)097[0862:aiicot]2.0.co;2. [PMID: 15279265]
  • Tomoo Kuge, Takashi Shibata, Michael S Willett. Wood creosote, the principal active ingredient of seirogan, an herbal antidiarrheal medicine: a single-dose, dose-escalation safety and pharmacokinetic study. Pharmacotherapy. 2003 Nov; 23(11):1391-400. doi: 10.1592/phco.23.14.1391.31940. [PMID: 14620385]
  • Grazyna Bieniek. Simultaneous determination of 2-methoxyphenol, 2-methoxy-4-methylphenol, 2,6-dimethoxyphenol and 4'-hydroxy-3'-methoxyacetophenone in urine by capillary gas chromatography. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences. 2003 Oct; 795(2):389-94. doi: 10.1016/s1570-0232(03)00593-2. [PMID: 14522045]
  • Giovanni Appendino, Selena Harrison, Luciano De Petrocellis, Nives Daddario, Federica Bianchi, Aniello Schiano Moriello, Marcello Trevisani, Francesca Benvenuti, Pierangelo Geppetti, Vincenzo Di Marzo. Halogenation of a capsaicin analogue leads to novel vanilloid TRPV1 receptor antagonists. British journal of pharmacology. 2003 Aug; 139(8):1417-24. doi: 10.1038/sj.bjp.0705387. [PMID: 12922928]
  • Numsen Hail. Mechanisms of vanilloid-induced apoptosis. Apoptosis : an international journal on programmed cell death. 2003 Jun; 8(3):251-62. doi: 10.1023/a:1023620821878. [PMID: 12766485]
  • Numsen Hail, Reuben Lotan. Examining the role of mitochondrial respiration in vanilloid-induced apoptosis. Journal of the National Cancer Institute. 2002 Sep; 94(17):1281-92. doi: 10.1093/jnci/94.17.1281. [PMID: 12208893]
  • T Kuge, T Shibata, M S Willett, P Turck, K A Traul. Lack of oncogenicity of wood creosote, the principal active ingredient of Seirogan, an herbal antidiarrheal medication, in Sprague-Dawley rats. International journal of toxicology. 2001 Sep; 20(5):297-305. doi: 10.1080/109158101753253036. [PMID: 11766127]
  • R L Dills, X Zhu, D A Kalman. Measurement of urinary methoxyphenols and their use for biological monitoring of wood smoke exposure. Environmental research. 2001 Feb; 85(2):145-58. doi: 10.1006/enrs.2000.4107. [PMID: 11161664]
  • D S Hsu, P Y Hsu, C C Liao. The first total synthesis of (+/-)-eremopetasidione. Organic letters. 2001 Jan; 3(2):263-5. doi: 10.1021/ol000355n. [PMID: 11430050]
  • N Ogata, T Shibata. Binding of alkyl- and alkoxy-substituted simple phenolic compounds to human serum proteins. Research communications in molecular pathology and pharmacology. 2000; 107(1-2):167-73. doi: NULL. [PMID: 11334365]
  • G Bieniek. Urinary excretion of phenols as an indicator of occupational exposure in the coke-plant industry. International archives of occupational and environmental health. 1997; 70(5):334-40. doi: 10.1007/s004200050227. [PMID: 9352337]
  • N Ogata, N Matsushima, T Shibata. Pharmacokinetics of wood creosote: glucuronic acid and sulfate conjugation of phenolic compounds. Pharmacology. 1995 Sep; 51(3):195-204. doi: 10.1159/000139335. [PMID: 7501706]
  • A Boersch, B A Callingham, F Lembeck, D F Sharman. Enzymic oxidation of capsaicin. Biochemical pharmacology. 1991 Jun; 41(12):1863-9. doi: 10.1016/0006-2952(91)90125-o. [PMID: 2039541]
  • H W SCHMIDT. [Protective measures in the preparation and use of dinitrocresol-containing plant pesticides]. Zeitschrift fur Unfallmedizin und Berufskrankheiten. Revue de medecine des accidents et des maladies professionelles. 1959 Sep; 52(?):257-60. doi: ". [PMID: 14443061]