5-Methyl-2-furancarboxaldehyde (BioDeep_00000397448)

 

Secondary id: BioDeep_00000008505, BioDeep_00000862889

human metabolite PANOMIX_OTCML-2023


代谢物信息卡片


5-Methylfuran-2-carbaldehyde;5-Methyl-2-furaldehyde

化学式: C6H6O2 (110.0367776)
中文名称: 5-甲基糠醛, 5-甲基呋喃醛
谱图信息: 最多检出来源 Homo sapiens(feces) 7.91%

分子结构信息

SMILES: CC1=CC=C(C=O)O1
InChI: InChI=1S/C6H6O2/c1-5-2-3-6(4-7)8-5/h2-4H,1H3

描述信息

5-Methyl-2-furancarboxaldehyde, also known as 5-methyl-2-furfural or 2-formyl-5-methylfuran, belongs to the class of organic compounds known as aryl-aldehydes. Aryl-aldehydes are compounds containing an aldehyde group directly attached to an aromatic ring. 5-Methyl-2-furancarboxaldehyde is an almond, burnt sugar, and caramel tasting compound. 5-methyl-2-furancarboxaldehyde has been detected, but not quantified, in several different foods, such as green bell peppers, red bell peppers, pepper (c. frutescens), orange bell peppers, and pepper (c. annuum). This could make 5-methyl-2-furancarboxaldehyde a potential biomarker for the consumption of these foods.
5-methyl-2-furaldehyde is a member of furans and an aldehyde. It has a role as a Maillard reaction product, a human metabolite, an EC 2.2.1.6 (acetolactate synthase) inhibitor and a flavouring agent.
5-Methylfurfural is a natural product found in Campsis grandiflora, Castanopsis cuspidata, and other organisms with data available.
5-methyl-2-furancarboxaldehyde is a metabolite found in or produced by Saccharomyces cerevisiae.
Isolated from brown algae and other plant sources, doubtless as a secondary production from saccharides. Flavouring ingredient. 5-Methyl-2-furancarboxaldehyde is found in many foods, some of which are pepper (c. frutescens), yellow bell pepper, red bell pepper, and pepper (c. annuum).

同义名列表

46 个代谢物同义名

5-Methylfuran-2-carbaldehyde;5-Methyl-2-furaldehyde; 5-Methyl-2-furfural; 5-Methylfuran-2-carbaldehyde; 5-Methylfurfural, analytical reference material; 5-Methylfurfural, Vetec(TM) reagent grade, 98\\%; 5-17-09-00404 (Beilstein Handbook Reference); InChI=1/C6H6O2/c1-5-2-3-6(4-7)8-5/h2-4H,1H3; 5-Methylfurfural, ReagentPlus(R), 99\\%; 2-FORMYL-5-METHYLTETRAHYDROFURAN; 2-Furancarboxaldehyde, 5-methyl-; 5-methyl-2-furancarboxyaldehyde; 5-Methyl-2-furancarboxaldehyde; 5-methylfuran-2-carboxaldehyde; 5-methyl-furan-2-carbaldehyde; 5-methyl-2-furancarbaldehyde; 5-Methylfuran-2-carbaldehyde; 5-Methylfurfural, >=98\\%, FG; 5-methylfuran-2 carbaldehyde; 5-METHYL-2-FURFURYLALDEHYDE; OUDFNZMQXZILJD-UHFFFAOYSA-; 5-Methyl-2-furfuraldehyde; 5-METHYLFURAN-2-ALDEHYDE; 2-Furaldehyde, 5-methyl-; 5-Methyl-2-furanaldehyde; 2-methylfuran-5-aldehyde; 5-METHYL FURFURAL [FHFI]; 5-methyl furfuraldehyde; 5-METHYL FURFURAL [FCC]; 5-Methylfurfuraldehyde; 5-methyl-2-furaldehyde; 2-Methyl-5-formylfuran; 2-Formyl-5-methylfuran; METHYL-5-FURALDEHYDE; 5-methyl furaldehyde; alpha-Methylfurfural; METHYL FURFURAL, 5-; 5-methyl-2-furfural; Furfural, 5-methyl-; 5-Methylfuran-2-al; 5-methyl-furfural; Methyl-5-furfural; 5-Methyl furfural; 5-Methylfurfural; 5-MethyIfurfural; methylfurfural; AI3-36591; FEMA 2702



数据库引用编号

15 个数据库交叉引用编号

分类词条

相关代谢途径

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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)

17 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

  • Konstantin V Kobelev, Irina N Gribkova, Larisa N Kharlamova, Armen V Danilyan, Maxim A Zakharov, Irina V Lazareva, Valery I Kozlov, Olga A Borisenko. Study of Brewer's Spent Grain Environmentally Friendly Processing Ways. Molecules (Basel, Switzerland). 2023 Jun; 28(11):. doi: 10.3390/molecules28114553. [PMID: 37299027]
  • Yun-Qi Wen, Hong-Wei Zhang, Chang-Hu Xue, Xiao-Han Wang, Shi-Jie Bi, Li-Li Xu, Qian-Qian Xue, Yong Xue, Zhao-Jie Li, Joaquín Velasco, Xiao-Ming Jiang. A chemometric study on the identification of 5-methylfurfural and 2-acetylfuran as particular volatile compounds of oxidized fish oil based on SHS-GC-IMS. Food chemistry. 2023 Jan; 399(?):133991. doi: 10.1016/j.foodchem.2022.133991. [PMID: 36037681]
  • Hassiba Aoudia, Nikoletta Ntalli, Nadhem Aissani, R Yahiaoui-Zaidi, Pierluigi Caboni. Nematotoxic phenolic compounds from Melia azedarach against Meloidogyne incognita. Journal of agricultural and food chemistry. 2012 Nov; 60(47):11675-80. doi: 10.1021/jf3038874. [PMID: 23136941]
  • Yong Foo Wong, Ahmad Makahleh, Khaldun M Al Azzam, Noorfatimah Yahaya, Bahruddin Saad, Siti Amrah Sulaiman. Micellar electrokinetic chromatography method for the simultaneous determination of furanic compounds in honey and vegetable oils. Talanta. 2012 Aug; 97(?):23-31. doi: 10.1016/j.talanta.2012.03.056. [PMID: 22841043]
  • Moises Alejandro Vazquez-Cruz, Sandra Neli Jimenez-Garcia, Irineo Torres-Pacheco, Salvador Horacio Guzman-Maldonado, Ramon Gerardo Guevara-Gonzalez, Rita Miranda-Lopez. Effect of maturity stage and storage on flavor compounds and sensory description of berrycactus (Myrtillocactus geometrizans). Journal of food science. 2012 Apr; 77(4):C366-73. doi: 10.1111/j.1750-3841.2012.02621.x. [PMID: 22429085]
  • Hyun Jeong Lee, In Hee Cho, Kyung Eun Lee, Young-Suk Kim. The compositions of volatiles and aroma-active compounds in dried omija fruits (Schisandra chinensis Baillon) according to the cultivation areas. Journal of agricultural and food chemistry. 2011 Aug; 59(15):8338-46. doi: 10.1021/jf200762h. [PMID: 21682319]
  • M M Ramírez-Rodrigues, M O Balaban, M R Marshall, R L Rouseff. Hot and cold water infusion aroma profiles of Hibiscus sabdariffa: fresh compared with dried. Journal of food science. 2011 Mar; 76(2):C212-7. doi: 10.1111/j.1750-3841.2010.01989.x. [PMID: 21535737]
  • Dattatraya G Naik, Hemalata Puntambekar, Priyanka Anantpure. Essential oil of Terminalia chebula fruits as a repellent for the indian honeybee Apis florea. Chemistry & biodiversity. 2010 May; 7(5):1303-10. doi: 10.1002/cbdv.200900274. [PMID: 20491085]
  • J S Ribeiro, F Augusto, T J G Salva, R A Thomaziello, M M C Ferreira. Prediction of sensory properties of Brazilian Arabica roasted coffees by headspace solid phase microextraction-gas chromatography and partial least squares. Analytica chimica acta. 2009 Feb; 634(2):172-9. doi: 10.1016/j.aca.2008.12.028. [PMID: 19185116]
  • Radoslava Trifonova, Joeke Postma, Francel W A Verstappen, Harro J Bouwmeester, Jan J M H Ketelaars, Jan-Dirk van Elsas. Removal of phytotoxic compounds from torrefied grass fibres by plant-beneficial microorganisms. FEMS microbiology ecology. 2008 Oct; 66(1):158-66. doi: 10.1111/j.1574-6941.2008.00508.x. [PMID: 18537835]
  • Osheiza Abdulmalik, Martin K Safo, Qiukan Chen, Jisheng Yang, Carlo Brugnara, Kwaku Ohene-Frempong, Donald J Abraham, Toshio Asakura. 5-hydroxymethyl-2-furfural modifies intracellular sickle haemoglobin and inhibits sickling of red blood cells. British journal of haematology. 2005 Feb; 128(4):552-61. doi: 10.1111/j.1365-2141.2004.05332.x. [PMID: 15686467]
  • M Kobaisy, M R Tellez, C L Webber, F E Dayan, K K Schrader, D E Wedge. Phytotoxic and fungitoxic activities of the essential oil of kenaf (Hibiscus cannabinus L.) leaves and its composition. Journal of agricultural and food chemistry. 2001 Aug; 49(8):3768-71. doi: 10.1021/jf0101455. [PMID: 11513663]
  • J Jodynis-Liebert. Metabolism of 5-methyl-2-furaldehyde in rat. III. Identification and determination of 5-methyl-2-furylmethylketone. Xenobiotica; the fate of foreign compounds in biological systems. 1988 Aug; 18(8):887-92. doi: 10.3109/00498258809167512. [PMID: 3188569]