1,2-Dimethoxybenzene (BioDeep_00000017477)

 

Secondary id: BioDeep_00000617460

human metabolite PANOMIX_OTCML-2023 Endogenous


代谢物信息卡片


Guaiacol Imp. C (EP); 1,2-Dimethoxybenzene; Veratrole; Guaiacol Impurity C

化学式: C8H10O2 (138.06807600000002)
中文名称: 邻苯二甲醚
谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 12.86%

分子结构信息

SMILES: COC1=CC=CC=C1OC
InChI: InChI=1S/C8H10O2/c1-9-7-5-3-4-6-8(7)10-2/h3-6H,1-2H3

描述信息

1,2-Dimethoxybenzene, commonly known as veratrole, is a chemical compound with the formula C6H4(OCH3)2. It is the dimethyl ether derived from pyrocatechol. Veratrole is slightly soluble in water, but miscible in all organic solvents. It is a building block for the organic synthesis of other aromatic compounds. Veratrole is relatively electron-rich and thus readily undergoes electrophilic substitution. 1,2-Dimethoxybenzene is found in corn. 1,2-Dimethoxybenzene is a food additive listed in the EAFUS food Additive Database (Jan 2001). 1,2-Dimethoxybenzene is found in raw and cooked foods, e.g. cheeses, grapes and asparagus.
Veratrole is a dimethoxybenzene with the methoxy groups at ortho-positions. It has a role as a plant metabolite.
1,2-Dimethoxybenzene is a natural product found in Ophrys sphegodes, Phallus impudicus, and other organisms with data available.
Food additive listed in the EAFUS Food Additive Database (Jan 2001). Found in raw and cooked foods, e.g. cheeses, grapes and asparagus
A dimethoxybenzene with the methoxy groups at ortho-positions.
1,2-Dimethoxybenzene is an naturally occurring insect attractant[1].
1,2-Dimethoxybenzene is an naturally occurring insect attractant[1].

同义名列表

46 个代谢物同义名

Guaiacol Imp. C (EP); 1,2-Dimethoxybenzene; Veratrole; Guaiacol Impurity C; 1,2-Dimethoxybenzene, Vetec(TM) reagent grade, 98\\%; InChI=1/C8H10O2/c1-9-7-5-3-4-6-8(7)10-2/h3-6H,1-2H; 1,2-Dimethoxybenzene, puriss., >=99.0\\% (GC); 1,2-Dimethoxybenzene, ReagentPlus(R), 99\\%; Dimethylether pyrokatechinu [Czech]; 1,2-Dimethoxybenzene (veratrole); 1,2-Dimethoxybenzene, >=99\\%, FG; 1,2-Dimethoxybenzene puriss.; Pyrocatechol dimethyl ether; ortho-dimethyl hydroquinone; Dimethylether pyrokatechinu; 1,2-DIMETHOXYBENZENE [FHFI]; Brenzkatechindimethylether; ghl.PD_Mitscher_leg0.397; Catechol dimethyl ether; Benzene, 1,2-dimethoxy-; catechol dimethylether; Orthodimethoxybenzene; 1,2-dimethoxy benzene; O,O-Dimethyl catechol; 1,2-dimethoxy-benzene; Benzene, o-dimethoxy-; 1,2-Dimethoxybenzene; Guaiacol methylether; o-dimethoxy-benzene; o-dimethoxybenzene; dimethoxy benzene; 2-Dimethoxybenzol; VERATROL [WHO-DD]; 2-Methoxyanisole; DIMETHOXYBENZENE; UNII-61WJZ2Q41I; Methyl guaiacol; NCIOpen2_004258; methylguaiacol; VERATROLE [MI]; Tox21_302297; WLN: 1OR BO1; CAS-91-16-7; 61WJZ2Q41I; FEMA 3799; AI3-02281; veratrole; Veratrol; Synthol



数据库引用编号

15 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)

8 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

  • Kristen Van Gelder, Taylor Forrester, Tariq A Akhtar. Evidence from stable-isotope labeling that catechol is an intermediate in salicylic acid catabolism in the flowers of Silene latifolia (white campion). Planta. 2020 Jun; 252(1):3. doi: 10.1007/s00425-020-03410-5. [PMID: 32514846]
  • Md Iqbal Alam, Mohammed A Alam, Ozair Alam, Amit Nargotra, Subhash Chandra Taneja, Surrinder Koul. Molecular modeling and snake venom phospholipase A2 inhibition by phenolic compounds: Structure-activity relationship. European journal of medicinal chemistry. 2016 May; 114(?):209-19. doi: 10.1016/j.ejmech.2016.03.008. [PMID: 26986086]
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  • Tariq A Akhtar, Eran Pichersky. Veratrole biosynthesis in white campion. Plant physiology. 2013 May; 162(1):52-62. doi: 10.1104/pp.113.214346. [PMID: 23547102]
  • Emine Nur Herken, Ali Celik, Mustafa Aslan, Nilüfer Aydınlık. The constituents of essential oil: antimicrobial and antioxidant activity of Micromeria congesta Boiss. & Hausskn. ex Boiss. from East Anatolia. Journal of medicinal food. 2012 Sep; 15(9):835-9. doi: 10.1089/jmf.2011.0315. [PMID: 22871061]
  • Alok K Gupta, Tariq A Akhtar, Alex Widmer, Eran Pichersky, Florian P Schiestl. Identification of white campion (Silene latifolia) guaiacol O-methyltransferase involved in the biosynthesis of veratrole, a key volatile for pollinator attraction. BMC plant biology. 2012 Aug; 12(?):158. doi: 10.1186/1471-2229-12-158. [PMID: 22937972]
  • Susu Zughaier, Prasanthi Karna, David Stephens, Ritu Aneja. Potent anti-inflammatory activity of novel microtubule-modulating brominated noscapine analogs. PloS one. 2010 Feb; 5(2):e9165. doi: 10.1371/journal.pone.0009165. [PMID: 20161797]
  • Marc O Waelti, Paul A Page, Alex Widmer, Florian P Schiestl. How to be an attractive male: floral dimorphism and attractiveness to pollinators in a dioecious plant. BMC evolutionary biology. 2009 Aug; 9(?):190. doi: 10.1186/1471-2148-9-190. [PMID: 19660122]
  • Yuko Kumano-Nomura, Ryohei Yamaoka. Beetle visitations, and associations with quantitative variation of attractants in floral odors of Homalomena propinqua (Araceae). Journal of plant research. 2009 Mar; 122(2):183-92. doi: 10.1007/s10265-008-0204-6. [PMID: 19110656]
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  • Yasmin Akhtar, Murray B Isman, Peggy M Paduraru, Srinivas Nagabandi, Ranjeet Nair, Erika Plettner. Screening of dialkoxybenzenes and disubstituted cyclopentene derivatives against the cabbage looper, Trichoplusia ni, for the discovery of new feeding and oviposition deterrents. Journal of agricultural and food chemistry. 2007 Dec; 55(25):10323-30. doi: 10.1021/jf071636d. [PMID: 18020407]
  • Umma Salma Jhumur, Stefan Dötterl, Andreas Jürgens. Naive and conditioned responses of Culex pipiens pipiens biotype molestus (Diptera: Culicidae) to flower odors. Journal of medical entomology. 2006 Nov; 43(6):1164-70. doi: . [PMID: 17162948]
  • Joëlle K Muhlemann, Marc O Waelti, Alex Widmer, Florian P Schiestl. Postpollination changes in floral odor in Silene latifolia: adaptive mechanisms for seed-predator avoidance?. Journal of chemical ecology. 2006 Aug; 32(8):1855-60. doi: 10.1007/s10886-006-9113-0. [PMID: 16807795]
  • Anna-Karin Borg-Karlson, Göran Nordlander, Anoma Mudalige, Henrik Nordenhem, C Rikard Unelius. Antifeedants in the feces of the pine weevil Hylobius abietis: identification and biological activity. Journal of chemical ecology. 2006 May; 32(5):943-57. doi: 10.1007/s10886-006-9050-y. [PMID: 16739015]
  • Ryszard Zadernowski, Marian Naczk, Jarosław Nesterowicz. Phenolic acid profiles in some small berries. Journal of agricultural and food chemistry. 2005 Mar; 53(6):2118-24. doi: 10.1021/jf040411p. [PMID: 15769144]
  • Stefan Dötterl, Lorne M Wolfe, Andreas Jürgens. Qualitative and quantitative analyses of flower scent in Silene latifolia. Phytochemistry. 2005 Jan; 66(2):203-13. doi: 10.1016/j.phytochem.2004.12.002. [PMID: 15652577]
  • Takashi Miki, Masakuni Kori, Hiroshi Mabuchi, Hiroshi Banno, Ryu ichi Tozawa, Masahira Nakamura, Shigekazu Itokawa, Yasuo Sugiyama, Hidefumi Yukimasa. Novel 4,1-benzoxazepine derivatives with potent squalene synthase inhibitory activities. Bioorganic & medicinal chemistry. 2002 Feb; 10(2):401-14. doi: 10.1016/s0968-0896(01)00290-5. [PMID: 11741788]
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