(R)-2-Hydroxy-2H-1,4-benzoxazin-3(4H)-one (BioDeep_00000014746)

 

Secondary id: BioDeep_00001871932

human metabolite blood metabolite


代谢物信息卡片


2-hydroxy-3,4-dihydro-2H-1,4-benzoxazin-3-one

化学式: C8H7NO3 (165.0425912)
中文名称:
谱图信息: 最多检出来源 Homo sapiens(blood) 0.04%

分子结构信息

SMILES: c12c(O[C@H](C(=O)N1)O)cccc2
InChI: InChI=1S/C8H7NO3/c10-7-8(11)12-6-4-2-1-3-5(6)9-7/h1-4,8,11H,(H,9,10)

描述信息

(R)-2-Hydroxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products. (R)-2-Hydroxy-2H-1,4-benzoxazin-3(4H)-one is a constituent of juvenile wheat (Triticum aestivum).
Constituent of juvenile wheat (Triticum aestivum). (R)-2-Hydroxy-2H-1,4-benzoxazin-3(4H)-one is found in wheat and cereals and cereal products.

同义名列表

7 个代谢物同义名

2-hydroxy-3,4-dihydro-2H-1,4-benzoxazin-3-one; (R)-2-Hydroxy-2H-1,4-benzoxazin-3(4H)-one; 2-Hydroxy-2H-1,4-benzoxazin-3(4H)-one; 2-Hydroxy-1,4-benzoxanzine-3(2H)-one; 2-Hydroxy-1,4-benzoxazin-3-one; HBOA CPD; HBOA



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(2)

PlantCyc(2)

代谢反应

88 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(2)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(86)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

5 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

  • Khem B Adhikari, Bente B Laursen, Per L Gregersen, Heidi J Schnoor, Marianne Witten, Lars K Poulsen, Bettina M Jensen, Inge S Fomsgaard. Absorption and metabolic fate of bioactive dietary benzoxazinoids in humans. Molecular nutrition & food research. 2013 Oct; 57(10):1847-58. doi: 10.1002/mnfr.201300107. [PMID: 23650214]
  • Manfred Beckmann, Amanda J Lloyd, Sumanto Haldar, Chris Seal, Kirsten Brandt, John Draper. Hydroxylated phenylacetamides derived from bioactive benzoxazinoids are bioavailable in humans after habitual consumption of whole grain sourdough rye bread. Molecular nutrition & food research. 2013 Oct; 57(10):1859-73. doi: 10.1002/mnfr.201200777. [PMID: 23681766]
  • Ummuhan Sebnem Harput, Okan Arihan, Alper B Iskit, Akito Nagatsu, Iclal Saracoglu. Antinociceptive, free radical-scavenging, and cytotoxic activities of Acanthus hirsutus Boiss. Journal of medicinal food. 2011 Jul; 14(7-8):767-74. doi: 10.1089/jmf.2010.0195. [PMID: 21480807]
  • Kati Hanhineva, Ilana Rogachev, Anna-Marja Aura, Asaph Aharoni, Kaisa Poutanen, Hannu Mykkänen. Qualitative characterization of benzoxazinoid derivatives in whole grain rye and wheat by LC-MS metabolite profiling. Journal of agricultural and food chemistry. 2011 Feb; 59(3):921-7. doi: 10.1021/jf103612u. [PMID: 21214244]
  • Hisashi Kato-Noguchi, Francisco A Macías, José M G Molinillo. Structure-activity relationship of benzoxazinones and related compounds with respect to the growth inhibition and alpha-amylase activity in cress seedlings. Journal of plant physiology. 2010 Oct; 167(15):1221-5. doi: 10.1016/j.jplph.2010.04.006. [PMID: 20605653]
  • Hermann M Niemeyer. Hydroxamic acids derived from 2-hydroxy-2H-1,4-benzoxazin-3(4H)-one: key defense chemicals of cereals. Journal of agricultural and food chemistry. 2009 Mar; 57(5):1677-96. doi: 10.1021/jf8034034. [PMID: 19199602]
  • Betty B Mogensen, Teddy Krongaard, Solvejg K Mathiassen, Per Kudsk. Quantification of benzoxazinone derivatives in wheat (Triticum aestivum) varieties grown under contrasting conditions in Denmark. Journal of agricultural and food chemistry. 2006 Feb; 54(4):1023-30. doi: 10.1021/jf052332z. [PMID: 16478212]
  • Marta Villagrasa, Miriam Guillamón, Ethel Eljarrat, Damià Barceló. Determination of benzoxazinone derivatives in plants by combining pressurized liquid extraction-solid-phase extraction followed by liquid chromatography-electrospray mass spectrometry. Journal of agricultural and food chemistry. 2006 Feb; 54(4):1001-8. doi: 10.1021/jf050897p. [PMID: 16478209]
  • Héctor R Bravo, Sylvia V Copaja, Sebastián Figueroa-Duarte, Madeleine Lamborot, José San Martín. 1,4-benzoxazin-3-one, 2-benzoxazolinone and gallic acid from Calceolaria thyrsiflora Graham and their antibacterial activity. Zeitschrift fur Naturforschung. C, Journal of biosciences. 2005 May; 60(5-6):389-93. doi: 10.1515/znc-2005-5-604. [PMID: 16042337]
  • Héctor R Bravo, Sylvia V Copaja, Victor H Argandoña. Chemical basis for the antifeedant activity of natural hydroxamic acids and related compounds. Journal of agricultural and food chemistry. 2004 May; 52(9):2598-601. doi: 10.1021/jf030766t. [PMID: 15113164]
  • H Otsuka, Y Hirai, T Nagao, K Yamasaki. Anti-inflammatory activity of benzoxazinoids from roots of Coix lachryma-jobi var. ma-yuen. Journal of natural products. 1988 Jan; 51(1):74-9. doi: 10.1021/np50055a009. [PMID: 2453615]
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