Ethyl benzoate (BioDeep_00000018181)

   

human metabolite Volatile Flavor Compounds natural product


代谢物信息卡片


2,4-Dihydroxy-6-methylbenzoic acid

化学式: C9H10O2 (150.06807600000002)
中文名称: 苯甲酸乙酯
谱图信息: 最多检出来源 Bos taurus(endogenous) 50%

分子结构信息

SMILES: CCOC(=O)C1=CC=CC=C1
InChI: InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3

描述信息

Ethyl benzoate, also known as benzoic ether or fema 2422, belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid. Ethyl benzoate is the ester formed by the condensation of benzoic acid and ethanol. It is a component of some artificial fruit flavors. It is a colorless liquid that is almost insoluble in water, but miscible with most organic solvents. As with many volatile esters, ethyl benzoate has a pleasant odor. Ethyl benzoate is a sweet, anise, and balsam tasting compound. Ethyl benzoate has been detected, but not quantified, in several different foods, such as black elderberries, pomes, alcoholic beverages, allspices, and blackcurrants. It has also been found in various fruits, e.g. apple, banana, sweet cherryand is also present in milk, butter, wines, black tea, bourbon vanilla and fruit brandies. Ethyl benzoate is a potentially toxic compound. ;
Found in various fruits, e.g. apple, banana, sweet cherryand is also present in milk, butter, wines, black tea, bourbon vanilla and fruit brandies. Flavouring agent

同义名列表

23 个代谢物同义名

2,4-Dihydroxy-6-methylbenzoic acid; Benzoic acid, C12-13-alkyl esters; Benzoic acid, C14-15-alkyl esters; Benzoic acid, C9-11-alkyl esters; 2,4-Dihydroxy-6-methylbenzoate; Ethyl benzenecarboxylic acid; Ethylester kyseliny benzoove; 2-Methoxy-1-phenyl-ethanone; 4,6-Dihydroxy-o-toluic acid; Benzoic acid, ethyl ester; Benzoic acid ethyl ester; Ethyl benzenecarboxylate; Benzoic acid,ethyl ester; Benzoate, ethyl ester; Benzoate ethyl ester; Benzoyl ethyl ether; Ethyl benzoic acid; o-Orsellinic acid; ETHYL BENZOATE; Benzoic ether; Orsellinate; FEMA 2422; Ethyl benzoate



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)

72 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

  • John J Beck, Bradley S Higbee, Douglas M Light, Wai S Gee, Glory B Merrill, Jennifer M Hayashi. Hull split and damaged almond volatiles attract male and female navel orangeworm moths. Journal of agricultural and food chemistry. 2012 Aug; 60(33):8090-6. doi: 10.1021/jf302658v. [PMID: 22849631]
  • Tapan Kumar Mohanta, Andrea Occhipinti, Simon Atsbaha Zebelo, Maria Foti, Judith Fliegmann, Simone Bossi, Massimo E Maffei, Cinzia M Bertea. Ginkgo biloba responds to herbivory by activating early signaling and direct defenses. PloS one. 2012; 7(3):e32822. doi: 10.1371/journal.pone.0032822. [PMID: 22448229]
  • Ilga Porth, Björn Hamberger, Richard White, Kermit Ritland. Defense mechanisms against herbivory in Picea: sequence evolution and expression regulation of gene family members in the phenylpropanoid pathway. BMC genomics. 2011 Dec; 12(?):608. doi: 10.1186/1471-2164-12-608. [PMID: 22177423]
  • W Walter Lorenz, Rob Alba, Yuan-Sheng Yu, John M Bordeaux, Marta Simões, Jeffrey F D Dean. Microarray analysis and scale-free gene networks identify candidate regulators in drought-stressed roots of loblolly pine (P. taeda L.). BMC genomics. 2011 May; 12(?):264. doi: 10.1186/1471-2164-12-264. [PMID: 21609476]
  • Sébastien Verne, Barry Jaquish, Rick White, Carol Ritland, Kermit Ritland. Global transcriptome analysis of constitutive resistance to the white pine weevil in spruce. Genome biology and evolution. 2011; 3(?):851-67. doi: 10.1093/gbe/evr069. [PMID: 21852250]
  • Justin G A Whitehill, Alexandra Popova-Butler, Kari B Green-Church, Jennifer L Koch, Daniel A Herms, Pierluigi Bonello. Interspecific proteomic comparisons reveal ash phloem genes potentially involved in constitutive resistance to the emerald ash borer. PloS one. 2011; 6(9):e24863. doi: 10.1371/journal.pone.0024863. [PMID: 21949771]
  • Jorge Toledo, Edi A Malo, Leopoldo Cruz-López, Julio C Rojas. Field evaluation of potential fruit-derived lures for Anastrepha obliqua (Diptera: Tephritidae). Journal of economic entomology. 2009 Dec; 102(6):2072-7. doi: 10.1603/029.102.0608. [PMID: 20069833]
  • Dirk W Lachenmeier, Pham Thi Hoang Anh, Svetlana Popova, Jürgen Rehm. The quality of alcohol products in Vietnam and its implications for public health. International journal of environmental research and public health. 2009 08; 6(8):2090-101. doi: 10.3390/ijerph6082090. [PMID: 19742208]
  • Ross N Crowhurst, Andrew P Gleave, Elspeth A MacRae, Charles Ampomah-Dwamena, Ross G Atkinson, Lesley L Beuning, Sean M Bulley, David Chagne, Ken B Marsh, Adam J Matich, Mirco Montefiori, Richard D Newcomb, Robert J Schaffer, Björn Usadel, Andrew C Allan, Helen L Boldingh, Judith H Bowen, Marcus W Davy, Rheinhart Eckloff, A Ross Ferguson, Lena G Fraser, Emma Gera, Roger P Hellens, Bart J Janssen, Karin Klages, Kim R Lo, Robin M MacDiarmid, Bhawana Nain, Mark A McNeilage, Maysoon Rassam, Annette C Richardson, Erik Ha Rikkerink, Gavin S Ross, Roswitha Schröder, Kimberley C Snowden, Edwige J F Souleyre, Matt D Templeton, Eric F Walton, Daisy Wang, Mindy Y Wang, Yanming Y Wang, Marion Wood, Rongmei Wu, Yar-Khing Yauk, William A Laing. Analysis of expressed sequence tags from Actinidia: applications of a cross species EST database for gene discovery in the areas of flavor, health, color and ripening. BMC genomics. 2008 Jul; 9(?):351. doi: 10.1186/1471-2164-9-351. [PMID: 18655731]
  • Norimoto Shimada, Shusei Sato, Tomoyoshi Akashi, Yasukazu Nakamura, Satoshi Tabata, Shin-Ichi Ayabe, Toshio Aoki. Genome-wide analyses of the structural gene families involved in the legume-specific 5-deoxyisoflavonoid biosynthesis of Lotus japonicus. DNA research : an international journal for rapid publication of reports on genes and genomes. 2007 Feb; 14(1):25-36. doi: 10.1093/dnares/dsm004. [PMID: 17452423]
  • Hiroshi Azuma, Masumi Kono. Estragole (4-allylanisole) is the primary compound in volatiles emitted from the male and female cones of Cycas revoluta. Journal of plant research. 2006 Nov; 119(6):671-6. doi: 10.1007/s10265-006-0019-2. [PMID: 16932996]
  • Bing-Ji Ma, Hua Peng, Ji-Kai Liu. Monitoring of BHT-quinone and BHT-CHO in the gas of capsules of Asclepias physocarpa. Zeitschrift fur Naturforschung. C, Journal of biosciences. 2006 May; 61(5-6):458-60. doi: 10.1515/znc-2006-5-625. [PMID: 16869508]
  • Leopoldo Cruz-López, Edi A Malo, Jorge Toledo, Armando Virgen, Alejandro Del Mazo, Julio C Rojas. A new potential attractant for Anastrepha obliqua from Spondias mombin fruits. Journal of chemical ecology. 2006 Feb; 32(2):351-65. doi: 10.1007/s10886-005-9006-7. [PMID: 16555133]
  • M Kwon, L B Davin, N G Lewis. In situ hybridization and immunolocalization of lignan reductases in woody tissues: implications for heartwood formation and other forms of vascular tissue preservation. Phytochemistry. 2001 Jul; 57(6):899-914. doi: 10.1016/s0031-9422(01)00108-x. [PMID: 11423140]
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