Heptyl acetate (BioDeep_00000020585)

   

human metabolite Endogenous natural product


代谢物信息卡片


Acetic acid N-heptyl ester

  化学式: C9H18O2 (158.1307)
中文名称: 乙酸庚酯
  谱图信息: 最多检出来源 Viridiplantae(not specific) 2.52%

分子结构信息

SMILES: CCCCCCCOC(=O)C
InChI: InChI=1S/C9H18O2/c1-3-4-5-6-7-8-11-9(2)10/h3-8H2,1-2H3


描述信息

Heptyl acetate, also known as heptanyl acetate and acetate C-7, is a colorless alcohol-soluble liquid that is the ester formed by the condensation of 1-heptanol and acetic acid. It can be found in alcoholic beverages. Heptyl acetate is present in apple, apricot, banana, orange peel, lemon peel, melon, Bartlett pears, other fruits, heated beef fat, ginger, wines and spirits.
Present in apple, apricot, banana, orange peel, lemon peel, melon, Bartlett pears, other fruits, heated beef fat, ginger, wines and spirits. Flavouring ingredient

同义名列表

15 个代谢物同义名

Acetic acid N-heptyl ester; Acetic acid, heptyl ester; Heptyl acetic acid; N-Heptyl ethanoate; Heptanyl acetate; N-Heptyl acetate; Heptyl ethanoate; 1-Heptyl acetate; Heptanol acetate; Heptyl acetate; Heptylacetat; Acetate C-7; Acetate C7; FEMA 2547; Heptyl acetate



数据库引用编号

11 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome()

BioCyc()

PlantCyc()

代谢反应

个相关的代谢反应过程信息。

Reactome()

BioCyc()

WikiPathways()

Plant Reactome()

INOH()

PlantCyc()

COVID-19 Disease Map()

PathBank()

PharmGKB()

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。

亚细胞结构定位 关联基因列表


文献列表

  • Ahmed M Saveer, Sophie H Kromann, Göran Birgersson, Marie Bengtsson, Tobias Lindblom, Anna Balkenius, Bill S Hansson, Peter Witzgall, Paul G Becher, Rickard Ignell. Floral to green: mating switches moth olfactory coding and preference. Proceedings. Biological sciences. 2012 Jun; 279(1737):2314-22. doi: 10.1098/rspb.2011.2710. [PMID: 22319127]
  • Martin Pareja, Erika Qvarfordt, Ben Webster, Patrick Mayon, John Pickett, Michael Birkett, Robert Glinwood. Herbivory by a Phloem-feeding insect inhibits floral volatile production. PloS one. 2012; 7(2):e31971. doi: 10.1371/journal.pone.0031971. [PMID: 22384116]
  • Zhudong Liu, Bo Wang, Bingbing Xu, Jianghua Sun. Monoterpene variation mediated attack preference evolution of the bark beetle Dendroctonus valens. PloS one. 2011; 6(7):e22005. doi: 10.1371/journal.pone.0022005. [PMID: 21811555]
  • Gary A Strobel, Berk Knighton, Katreena Kluck, Yuhao Ren, Tom Livinghouse, Meghan Griffin, Daniel Spakowicz, Joe Sears. The production of myco-diesel hydrocarbons and their derivatives by the endophytic fungus Gliocladium roseum (NRRL 50072). Microbiology (Reading, England). 2008 Nov; 154(Pt 11):3319-3328. doi: 10.1099/mic.0.2008/022186-0. [PMID: 18957585]
  • Alison L Fisher, Elizabeth DePuy, Andrew Jayaraj, Conrad Raab, Matt Braun, Michel Ellis-Hutchings, Jin Zhang, John D Rogers, Donald G Musson. LC/MS/MS plasma assay for the peptidomimetic VLA4 antagonist I and its major active metabolite II: for treatment of asthma by inhalation. Journal of pharmaceutical and biomedical analysis. 2002 Jan; 27(1-2):57-71. doi: 10.1016/s0731-7085(01)00496-4. [PMID: 11682211]
  • S Marklund. Determination of plasma or serum haemoglobin by peroxidase activity employing 2,2'-azino-di-(3-ethyl-benzthiazolinsulphonate-6) as chromogen. Scandinavian journal of clinical and laboratory investigation. 1978 Oct; 38(6):543-7. doi: 10.1080/00365517809108817. [PMID: 30165]