Behenic acid (BioDeep_00000003630)

 

Secondary id: BioDeep_00000400546, BioDeep_00000628675, BioDeep_00000859623

natural product human metabolite PANOMIX_OTCML-2023 Endogenous blood metabolite


代谢物信息卡片


Docosanoic acid from Rapeseed

化学式: C22H44O2 (340.3341124)
中文名称: 山嵛酸, 二十二酸, 二十二烷酸
谱图信息: 最多检出来源 Homo sapiens(blood) 0.38%

分子结构信息

SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)O
InChI: InChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)

描述信息

Behenic acid, also known as docosanoate or 1-docosanoic acid, 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, behenic acid is considered to be a fatty acid lipid molecule. Behenic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Behenic acid can be found in a number of food items such as rice, opium poppy, pepper (c. frutescens), and gram bean, which makes behenic acid a potential biomarker for the consumption of these food products. Behenic acid can be found primarily in blood, feces, and urine. Behenic acid (also docosanoic acid) is a carboxylic acid, the saturated fatty acid with formula C21H43COOH. In appearance, it consists of white to cream color crystals or powder with a melting point of 80 °C and boiling point of 306 °C .
Behenic acid, also docosanoic acid, is a normal carboxylic acid, a fatty acid with formula C21H43COOH. It is an important constituent of the behen oil extracted from the seeds of the Ben-oil tree, and it is so named from the Persian month Bahman when the roots of this tree were harvested. Behenic acid has been identified in the human placenta (PMID:32033212).
Docosanoic acid is poorly absorbed, and a cholesterol-raising saturated fatty acid in humans.
Docosanoic acid is poorly absorbed, and a cholesterol-raising saturated fatty acid in humans.

同义名列表

20 个代谢物同义名

Docosanoic acid from Rapeseed; N-Docosanoic acid; 1-Docosanoic acid; CH3-[CH2]20-COOH; Docosanoic acid; Docosanic acid; N-Docosanoate; Docosoic acid; 1-Docosanoate; Docosansaeure; Dokosansaeure; Behenic acid; Behensaeure; Behnic acid; Docosanoate; Docosanate; Docosoate; Behenate; FA(22:0); Docosanoic Acid



数据库引用编号

24 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

398 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(0)

WikiPathways(1)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(397)

PharmGKB(0)

275 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

  • Adam Yasgar, Danielle Bougie, Richard T Eastman, Ruili Huang, Misha Itkin, Jennifer Kouznetsova, Caitlin Lynch, Crystal McKnight, Mitch Miller, Deborah K Ngan, Tyler Peryea, Pranav Shah, Paul Shinn, Menghang Xia, Xin Xu, Alexey V Zakharov, Anton Simeonov. Quantitative Bioactivity Signatures of Dietary Supplements and Natural Products. ACS pharmacology & translational science. 2023 May; 6(5):683-701. doi: 10.1021/acsptsci.2c00194. [PMID: 37200814]
  • Shizhuang Weng, Zhaojie Chu, Manqin Wang, Kaixuan Han, Gongqin Zhu, Cunchuan Liu, Xinhua Li, Linsheng Huang. Reflectance spectroscopy with operator difference for determination of behenic acid in edible vegetable oils by using convolutional neural network and polynomial correction. Food chemistry. 2022 Jan; 367(?):130668. doi: 10.1016/j.foodchem.2021.130668. [PMID: 34343814]
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