b-Resorcylaldehyde (BioDeep_00000871809)

Main id: BioDeep_00000021521

 

PANOMIX_OTCML-2023


Metabolite Card


(1RS,2RS)-Guaiacylglycerol 2-glucoside

  Formula: C7H6O3 (138.0317)
Chinese Names: 2,4-二羟基苯甲醛
  Spectrum Hits: Top Source () %

Molecular Structure

SMILES: C1=CC(=C(C=C1O)O)C=O
InChI: InChI=1S/C36H46O22/c37-6-20-25(39)28(42)31(45)34(55-20)49-10-24-27(41)30(44)33(58-35-32(46)29(43)26(40)21(7-38)56-35)36(57-24)54-16-5-19-18(52-12-53-19)4-14(16)23-9-47-22(8-48-23)13-1-2-15-17(3-13)51-11-50-15/h1-5,20-46H,6-12H2/t20-,21-,22+,23+,24-,25-,26-,27-,28+,29+,30+,31-,32-,33-,34-,35+,36-/m1/s1


Description

Isolated from Pinus sylvestris ( Scotch pine) needles.
A polyphenol metabolite detected in biological fluids [PhenolExplorer]
2,4-Dihydroxybenzaldehyde is an endogenous metabolite.
2,4-Dihydroxybenzaldehyde is an endogenous metabolite.

Synonyms

4 synonym names

2,4-DIHYDROXYBENZALDEHYDE; b-Resorcylaldehyde; (1RS,2RS)-Guaiacylglycerol 2-glucoside; Sesaminol 2-triglucoside



Cross Reference

9 cross reference id

Classification Terms

Related Pathways

Reactome()

BioCyc()

PlantCyc()

Biological Process

related biological process reactions.

Reactome()

BioCyc()

WikiPathways()

Plant Reactome()

INOH()

PlantCyc()

COVID-19 Disease Map()

PathBank()

PharmGKB()

8 organism taxonomy source information

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。

Sub-cellular location Genes


Literature Reference

  • Md Iqbal Alam, Mohammed A Alam, Ozair Alam, Amit Nargotra, Subhash Chandra Taneja, Surrinder Koul. Molecular modeling and snake venom phospholipase A2 inhibition by phenolic compounds: Structure-activity relationship. European journal of medicinal chemistry. 2016 May; 114(?):209-19. doi: 10.1016/j.ejmech.2016.03.008. [PMID: 26986086]
  • Myeong Hyeon Park, In Sook Kim, Sun-A Kim, Chun-Soo Na, Cheol Yi Hong, Mi-Sook Dong, Hye Hyun Yoo. Inhibitory effect of Rhus verniciflua Stokes extract on human aromatase activity; butin is its major bioactive component. Bioorganic & medicinal chemistry letters. 2014 Apr; 24(7):1730-3. doi: 10.1016/j.bmcl.2014.02.039. [PMID: 24630560]
  • Hussein S Seleem, Gaber A El-Inany, Bashir A El-Shetary, Marwa A Mousa. The ligational behavior of a phenolic quinolyl hydrazone towards copper(II)- ions. Chemistry Central journal. 2011 Jan; 5(1):2. doi: 10.1186/1752-153x-5-2. [PMID: 21223587]
  • Vanisree Mulabagal, Ruby L Alexander-Lindo, David L Dewitt, Muraleedharan G Nair. Health-Beneficial Phenolic Aldehyde in Antigonon leptopus Tea. Evidence-based complementary and alternative medicine : eCAM. 2011; 2011(?):601249. doi: 10.1093/ecam/nep041. [PMID: 19454555]
  • Brígida Fernández de Simón, Enrique Esteruelas, Angel M Muñoz, Estrella Cadahía, Miriam Sanz. Volatile compounds in acacia, chestnut, cherry, ash, and oak woods, with a view to their use in cooperage. Journal of agricultural and food chemistry. 2009 Apr; 57(8):3217-27. doi: 10.1021/jf803463h. [PMID: 19290598]
  • Chao-Bin Xue, Li Zhang, Wan-Chun Luo, Xian-Ye Xie, Lin Jiang, Ting Xiao. 3D-QSAR and molecular docking studies of benzaldehyde thiosemicarbazone, benzaldehyde, benzoic acid, and their derivatives as phenoloxidase inhibitors. Bioorganic & medicinal chemistry. 2007 Mar; 15(5):2006-15. doi: 10.1016/j.bmc.2006.12.038. [PMID: 17258462]
  • Fumihiro Ito, Misako Iwasaki, Toshiko Watanabe, Tsutomu Ishikawa, Yoshihiro Higuchi. The first total synthesis of kwakhurin, a characteristic component of a rejuvenating plant, 'kwao keur': toward an efficient synthetic route to phytoestrogenic isoflavones. Organic & biomolecular chemistry. 2005 Feb; 3(4):674-81. doi: 10.1039/b414955f. [PMID: 15703807]