Benzylacetone (BioDeep_00000397411)

 

Secondary id: BioDeep_00000025986, BioDeep_00000861518

PANOMIX_OTCML-2023 Volatile Flavor Compounds natural product


代谢物信息卡片


1-Phenyl-3-butanone;2-Butanone, 4-phenyl-;4-Phenyl-2-butanoine

化学式: C10H12O (148.08881019999998)
中文名称: 苄丙酮, 苄基丙酮
谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 5.48%

分子结构信息

SMILES: CC(=O)CCC1=CC=CC=C1
InChI: InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3

描述信息

4-phenylbutan-2-one is a ketone.
Benzylacetone is a natural product found in Aquilaria sinensis, Aquilaria malaccensis, and other organisms with data available.
Benzylacetone is an aromatic compound from agarwood[1]. Benzylacetone exhibits potent and reversible antityrosinase (mushroom) activity， with IC50s of 2.8 mM and 0.6 mM for monophenolase and diphenolase, respectively[2]. Benzylacetone has appetite-enhancing and locomotor-reducing effects[3].
Benzylacetone is an aromatic compound from agarwood[1]. Benzylacetone exhibits potent and reversible antityrosinase (mushroom) activity， with IC50s of 2.8 mM and 0.6 mM for monophenolase and diphenolase, respectively[2]. Benzylacetone has appetite-enhancing and locomotor-reducing effects[3].

同义名列表

30 个代谢物同义名

1-Phenyl-3-butanone;2-Butanone, 4-phenyl-;4-Phenyl-2-butanoine; 4-07-00-00713 (Beilstein Handbook Reference); 4-Phenyl-2-butanone, analytical standard; .beta.-Phenylethyl methyl ketone; beta-Phenylethyl methyl ketone; Methyl 2-phenylethyl ketone; 2-Phenylethyl methyl ketone; 4-Phenyl-2-butanone, 98\\%; Methyl phenylethyl ketone; Methyl 2-phenethyl ketone; Phenethyl methyl ketone; Methyl phenethyl ketone; 2-Butanone, 4-phenyl-; 4-Phenyl-butan-2-one; 4-Phenylbutan-2-one; 1-Phenyl-3-butanone; 4-Phenyl-2-butanone; 1-phenylbutan-3-one; 4-Penylbutan-2-one; 4-PHENYL BUTANONE; 4-phenylbutanone; UNII-UZM5QH16YW; benzyl acetone; Benzylacetone; Tox21_201240; Tox21_303341; UZM5QH16YW; AI3-15123; Nachal1; Benzylacetone



数据库引用编号

9 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)

30 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

  • Bao-Tong Mo, Hao Guo, Guo-Cheng Li, Lin-Lin Cao, Xin-Lin Gong, Ling-Qiao Huang, Chen-Zhu Wang. Discovery of Insect Attractants Based on the Functional Analyses of Female-Biased Odorant Receptors and Their Orthologs in Two Closely Related Species. Journal of agricultural and food chemistry. 2023 Dec; 71(49):19408-19421. doi: 10.1021/acs.jafc.3c05368. [PMID: 38039319]
  • Jianwei Chen, Yaojia Lu, Xinyi Ye, Mahmoud Emam, Huawei Zhang, Hong Wang. Current advances in Vibrio harveyi quorum sensing as drug discovery targets. European journal of medicinal chemistry. 2020 Dec; 207(?):112741. doi: 10.1016/j.ejmech.2020.112741. [PMID: 32871343]
  • Han Guo, Nathalie D Lackus, Tobias G Köllner, Ran Li, Julia Bing, Yangzi Wang, Ian T Baldwin, Shuqing Xu. Evolution of a Novel and Adaptive Floral Scent in Wild Tobacco. Molecular biology and evolution. 2020 04; 37(4):1090-1099. doi: 10.1093/molbev/msz292. [PMID: 31808808]
  • Ran Li, Meredith C Schuman, Yang Wang, Lucas Cortés Llorca, Julia Bing, Anne Bennion, Rayko Halitschke, Ian T Baldwin. Jasmonate signaling makes flowers attractive to pollinators and repellant to florivores in nature. Journal of integrative plant biology. 2018 Mar; 60(3):190-194. doi: 10.1111/jipb.12607. [PMID: 29058786]
  • Danny Kessler, Mario Kallenbach, Celia Diezel, Eva Rothe, Mark Murdock, Ian T Baldwin. How scent and nectar influence floral antagonists and mutualists. eLife. 2015 Jul; 4(?):. doi: 10.7554/elife.07641. [PMID: 26132861]
  • Michael Stitz, Markus Hartl, Ian T Baldwin, Emmanuel Gaquerel. Jasmonoyl-L-isoleucine coordinates metabolic networks required for anthesis and floral attractant emission in wild tobacco (Nicotiana attenuata). The Plant cell. 2014 Oct; 26(10):3964-83. doi: 10.1105/tpc.114.128165. [PMID: 25326292]
  • Yan-Yan Zhao, Zhi-Jian Pang. [GC-MS analysis of volatile oil components from Aquilariae Lignum Resinatum concreted by a new artificial method]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials. 2013 Jun; 36(6):929-33. doi: ". [PMID: 24380278]
  • Samik Bhattacharya, Ian T Baldwin. The post-pollination ethylene burst and the continuation of floral advertisement are harbingers of non-random mate selection in Nicotiana attenuata. The Plant journal : for cell and molecular biology. 2012 Aug; 71(4):587-601. doi: 10.1111/j.1365-313x.2012.05011.x. [PMID: 22458597]
  • NULL. Toxicology and carcinogenesis studies of methyl trans-styryl ketone (CAS NO 1896-62-4) in F344/N rats and B6C3F1 mice (feed and dermal studies). National Toxicology Program technical report series. 2012 May; ?(572):1-188. doi: NULL. [PMID: 22692228]
  • Delfina A Ré, Brenda Raud, Raquel L Chan, Ian T Baldwin, Gustavo Bonaventure. RNAi-mediated silencing of the HD-Zip gene HD20 in Nicotiana attenuata affects benzyl acetone emission from corollas via ABA levels and the expression of metabolic genes. BMC plant biology. 2012 May; 12(?):60. doi: 10.1186/1471-2229-12-60. [PMID: 22548747]
  • 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]
  • Kai Yang, Yu Xin Zhou, Cheng Fang Wang, Shu Shan Du, Zhi Wei Deng, Qi Zhi Liu, Zhi Long Liu. Toxicity of Rhododendron anthopogonoides essential oil and its constituent compounds towards Sitophilus zeamais. Molecules (Basel, Switzerland). 2011 Aug; 16(9):7320-30. doi: 10.3390/molecules16097320. [PMID: 22143541]
  • Sang-Gyu Kim, Felipe Yon, Emmanuel Gaquerel, Jyotasana Gulati, Ian T Baldwin. Tissue specific diurnal rhythms of metabolites and their regulation during herbivore attack in a native tobacco, Nicotiana attenuata. PloS one. 2011; 6(10):e26214. doi: 10.1371/journal.pone.0026214. [PMID: 22028833]
  • Delfina A Ré, Carlos A Dezar, Raquel L Chan, Ian T Baldwin, Gustavo Bonaventure. Nicotiana attenuata NaHD20 plays a role in leaf ABA accumulation during water stress, benzylacetone emission from flowers, and the timing of bolting and flower transitions. Journal of experimental botany. 2011 Jan; 62(1):155-66. doi: 10.1093/jxb/erq252. [PMID: 20713465]
  • Patcharee Pripdeevech, Ekachai Chukeatirote. Chemical compositions, antifungal and antioxidant activities of essential oil and various extracts of Melodorum fruticosum L. flowers. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association. 2010 Oct; 48(10):2754-8. doi: 10.1016/j.fct.2010.07.002. [PMID: 20621150]
  • Siham Bezzi, Danny Kessler, Celia Diezel, Alexander Muck, Samir Anssour, Ian T Baldwin. Silencing NaTPI expression increases nectar germin, nectarins, and hydrogen peroxide levels and inhibits nectar removal from plants in nature. Plant physiology. 2010 Apr; 152(4):2232-42. doi: 10.1104/pp.109.151753. [PMID: 20190094]
  • Danny Kessler, Celia Diezel, Ian T Baldwin. Changing pollinators as a means of escaping herbivores. Current biology : CB. 2010 Feb; 20(3):237-42. doi: 10.1016/j.cub.2009.11.071. [PMID: 20096581]
  • Robert A Raguso. Plant science. The 'invisible hand' of floral chemistry. Science (New York, N.Y.). 2008 Aug; 321(5893):1163-4. doi: 10.1126/science.1163570. [PMID: 18755960]
  • Hiroaki Takemoto, Michiho Ito, Tomohiro Shiraki, Toru Yagura, Gisho Honda. Sedative effects of vapor inhalation of agarwood oil and spikenard extract and identification of their active components. Journal of natural medicines. 2008 Jan; 62(1):41-6. doi: 10.1007/s11418-007-0177-0. [PMID: 18404340]
  • Danny Kessler, Ian T Baldwin. Making sense of nectar scents: the effects of nectar secondary metabolites on floral visitors of Nicotiana attenuata. The Plant journal : for cell and molecular biology. 2007 Mar; 49(5):840-54. doi: 10.1111/j.1365-313x.2006.02995.x. [PMID: 17316174]
  • Cristian Desmarchelier, Adriana del V Pacciaroni, Daniel Abate-Daga, Jorge Coussio, Roberto R Gil, Gloria L Silva. Antioxidant and free radical scavenging activities of Misodendrum punctulatum, myzodendrone and structurally related phenols. Phytotherapy research : PTR. 2005 Dec; 19(12):1043-7. doi: 10.1002/ptr.1786. [PMID: 16372370]
  • Marco W Fraaije, Nanne M Kamerbeek, Annelies J Heidekamp, Riccardo Fortin, Dick B Janssen. The prodrug activator EtaA from Mycobacterium tuberculosis is a Baeyer-Villiger monooxygenase. The Journal of biological chemistry. 2004 Jan; 279(5):3354-60. doi: 10.1074/jbc.m307770200. [PMID: 14610090]
  • Karen R Sime, Ian T Baldwin. Opportunistic out-crossing in Nicotiana attenuata (Solanaceae), a predominantly self-fertilizing native tobacco. BMC ecology. 2003 Jul; 3(?):6. doi: 10.1186/1472-6785-3-6. [PMID: 12866951]