Docosanedioic acid (BioDeep_00000001102)

 

Secondary id: BioDeep_00000867298, BioDeep_00001867595

human metabolite PANOMIX_OTCML-2023 natural product


代谢物信息卡片


1,20-Eicosanedicarboxylic acid

化学式: C22H42O4 (370.30829320000004)
中文名称: 二十二烷二酸, 山嵛酸/二十二碳烷酸
谱图信息: 最多检出来源 Viridiplantae(plant) 1.74%

分子结构信息

SMILES: C(CCCCCCCCCCC(=O)O)CCCCCCCCCC(=O)O
InChI: InChI=1S/C22H42O4/c23-21(24)19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22(25)26/h1-20H2,(H,23,24)(H,25,26)

描述信息

Phellogenic acid, also known as 1,20-eicosanedicarboxylic acid or 1,22-docosanedioate, is a member of the class of compounds known as very long-chain fatty acids. Very long-chain fatty acids are fatty acids with an aliphatic tail that contains at least 22 carbon atoms. Thus, phellogenic acid is considered to be a fatty acid lipid molecule. Phellogenic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Phellogenic acid can be found in potato, which makes phellogenic acid a potential biomarker for the consumption of this food product.
Docosanedioic acid is an alpha,omega-dicarboxylic acid that is docosane in which the methyl groups have been oxidised to the corresponding carboxylic acids. It has a role as a metabolite. It is an alpha,omega-dicarboxylic acid and a dicarboxylic fatty acid. It is a conjugate acid of a docosanedioate(2-). It derives from a hydride of a docosane.
Docosanedioic acid is a natural product found in Pinus radiata with data available.

同义名列表

21 个代谢物同义名

1,20-Eicosanedicarboxylic acid; 1,20-icosanedicarboxylic acid; 1,20-Eicosanedicarboxylate; 1,20-Icosanedicarboxylate; 1,22-Docosane dioic acid; Docosanedioic acid, 85\\%; 2-Amino-4fluorobenzamide; 1,22-Docosanedioic acid; Docosan-1,22-dioic acid; 1,22-Docosanedioate; Docosanedioic acid; Docosandioic acid; Docosanedioicacid; Phellogenic acid; UNII-FR7J081T20; Docosanedioate; Felogenic acid; Phellogenate; FA 22:1;O2; FR7J081T20; Felogenate



数据库引用编号

20 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)

10 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。

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