Rotundone (BioDeep_00000638506)

   


代谢物信息卡片


(3S,5R,8S)-3,8-dimethyl-5-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-azulen-1-one

化学式: C15H22O (218.1670562)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C1C[C@H](C)C2C(=O)C[C@H](C)C=2C[C@@H]1C(=C)C
InChI: InChI=1S/C15H22O/c1-9(2)12-6-5-10(3)15-13(8-12)11(4)7-14(15)16/h10-12H,1,5-8H2,2-4H3/t10-,11-,12+/m0/s1

描述信息

同义名列表

2 个代谢物同义名

Rotundone; (3S,5R,8S)-3,8-dimethyl-5-prop-1-en-2-yl-3,4,5,6,7,8-hexahydro-2H-azulen-1-one



数据库引用编号

4 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)

0 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

  • Tianyue An, Linsheng Li, Ying Lin, Fanqi Zeng, Pengcheng Lin, Jiachen Zi. Characterization of Guaiene Synthases from Stellera chamaejasme L. Flowers and Their Application in De novo Production of (-)-Rotundone in Yeast. Journal of agricultural and food chemistry. 2020 Mar; 68(10):3214-3219. doi: 10.1021/acs.jafc.9b08303. [PMID: 32079394]
  • Akira Nakanishi, Makiko Ito, Keisuke Yoshikawa, Tomoko Maeda, Susumu Ishizaki, Yoshiko Kurobayashi. Identification and Characterization of 3-epi-Rotundone, a Novel Stereoisomer of Rotundone, in Several Kinds of Fruits. Journal of agricultural and food chemistry. 2017 Jun; 65(25):5209-5214. doi: 10.1021/acs.jafc.7b01696. [PMID: 28597655]
  • Akira Nakanishi, Yusuke Fukushima, Norio Miyazawa, Keisuke Yoshikawa, Tomoko Maeda, Yoshiko Kurobayashi. Identification of Rotundone as a Potent Odor-Active Compound of Several Kinds of Fruits. Journal of agricultural and food chemistry. 2017 Jun; 65(22):4464-4471. doi: 10.1021/acs.jafc.7b00929. [PMID: 28516769]
  • Johannes Niebler, Katharina Zhuravlova, Mirjana Minceva, Andrea Buettner. Fragrant Sesquiterpene Ketones as Trace Constituents in Frankincense Volatile Oil of Boswellia sacra. Journal of natural products. 2016 Apr; 79(4):1160-4. doi: 10.1021/acs.jnatprod.5b00836. [PMID: 27010489]
  • Damian Paul Drew, Trine Bundgaard Andersen, Crystal Sweetman, Birger Lindberg Møller, Christopher Ford, Henrik Toft Simonsen. Two key polymorphisms in a newly discovered allele of the Vitis vinifera TPS24 gene are responsible for the production of the rotundone precursor α-guaiene. Journal of experimental botany. 2016 Feb; 67(3):799-808. doi: 10.1093/jxb/erv491. [PMID: 26590310]
  • Hideki Takase, Kanako Sasaki, Hideyuki Shinmori, Akira Shinohara, Chihiro Mochizuki, Hironori Kobayashi, Gen Ikoma, Hiroshi Saito, Hironori Matsuo, Shunji Suzuki, Ryoji Takata. Cytochrome P450 CYP71BE5 in grapevine (Vitis vinifera) catalyzes the formation of the spicy aroma compound (-)-rotundone. Journal of experimental botany. 2016 Feb; 67(3):787-98. doi: 10.1093/jxb/erv496. [PMID: 26590863]
  • Pangzhen Zhang, Snow Barlow, Mark Krstic, Markus Herderich, Sigfredo Fuentes, Kate Howell. Within-Vineyard, Within-Vine, and Within-Bunch Variability of the Rotundone Concentration in Berries of Vitis vinifera L. cv. Shiraz. Journal of agricultural and food chemistry. 2015 May; 63(17):4276-83. doi: 10.1021/acs.jafc.5b00590. [PMID: 25891266]
  • An-Cheng Huang, Stacey Burrett, Mark A Sefton, Dennis K Taylor. Production of the pepper aroma compound, (-)-rotundone, by aerial oxidation of α-guaiene. Journal of agricultural and food chemistry. 2014 Nov; 62(44):10809-15. doi: 10.1021/jf504693e. [PMID: 25307830]
  • Tracey E Siebert, Claudia Wood, Gordon M Elsey, Alan P Pollnitz. Determination of rotundone, the pepper aroma impact compound, in grapes and wine. Journal of agricultural and food chemistry. 2008 May; 56(10):3745-8. doi: 10.1021/jf800184t. [PMID: 18461962]