2-Hydroxymethylanthraquinone (BioDeep_00000008041)

 

Secondary id: BioDeep_00000396965, BioDeep_00000862283

human metabolite PANOMIX_OTCML-2023 natural product PANOMIX_OTCML-2025


代谢物信息卡片


2-(hydroxymethyl)-9,10-dihydroanthracene-9,10-dione

  化学式: C15H10O3 (238.063)
中文名称: 2-羟基-3-甲基蒽醌, 2-(羟甲基)蒽醌, 2-羟甲基蒽醌(请核实!), 2-（羟甲基）蒽醌
  谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 71.21%

分子结构信息

SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)CO
InChI: InChI=1S/C15H10O3/c16-8-9-5-6-12-13(7-9)15(18)11-4-2-1-3-10(11)14(12)17/h1-7,16H,8H2


描述信息

2-hydroxymethylanthraquinone, also known as anthraquinone-2-methanol or hmaq-one, is a member of the class of compounds known as anthraquinones. Anthraquinones are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone. 2-hydroxymethylanthraquinone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 2-hydroxymethylanthraquinone can be found in turmeric, which makes 2-hydroxymethylanthraquinone a potential biomarker for the consumption of this food product.
2-(Hydroxymethyl)anthraquinone is used as a photoremovable protecting group (PRPG) to chemically cage sex pheromone (e.g. (Z)-11-hexadecen-1-ol (sex pheromone of?Chilo infuscatellussnellen))[1].
2-(Hydroxymethyl)anthraquinone is used as a photoremovable protecting group (PRPG) to chemically cage sex pheromone (e.g. (Z)-11-hexadecen-1-ol (sex pheromone of?Chilo infuscatellussnellen))[1].

同义名列表

24 个代谢物同义名

2-(hydroxymethyl)-9,10-dihydroanthracene-9,10-dione; 2-Hydroxy-3-methyl-9,10-anthraquinone; 2-(hydroxymethyl)-9,10-anthraquinone; 2-(Hydroxymethyl)anthraquinone; 2-Hydroxymethylanthraquinone; Anthraquinone-2-methanol; HMAQ-one; 2-Hydroxymethylanthraquinone; 2-(Hydroxymethyl)anthraquinone; 2-(hydroxymethyl)anthracene-9,10-dione; 2-methylol-9,10-anthraquinone; 17241-59-7; BRN 2120452; ST5308365; 4-08-00-02607 (Beilstein Handbook Reference); CHEBI:28649; CCRIS 3522; EINECS 241-274-3; C10354; 9,10-Anthracenedione, 2-(hydroxymethyl)-; 2-Hydroxymethyl-9,10-anthracenedione; 226521_ALDRICH; Anthraquinone, 2-(hydroxymethyl)-; ZINC03861620



数据库引用编号

19 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome()

BioCyc()

PlantCyc()

代谢反应

个相关的代谢反应过程信息。

Reactome()

BioCyc()

WikiPathways()

Plant Reactome()

INOH()

PlantCyc()

COVID-19 Disease Map()

PathBank()

PharmGKB()

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

  • Mingming Xu, Junfei Zhou, Ding Heng, Xiaorong Su, Monday M Onakpa, Yuefan Bai, Jin-Ao Duan, Chun-Tao Che, Hongkai Bi, Ming Zhao. Quinone Derivatives as Promising Anti-Helicobacter pylori Agents from Aerial Parts of Mitracarpus hirtus. Journal of natural products. 2022 04; 85(4):1029-1038. doi: 10.1021/acs.jnatprod.1c01163. [PMID: 35412828]
  • Manmohan Singhal, Niraj Kansara. Cassia tora Linn Cream Inhibits Ultraviolet-B-Induced Psoriasis in Rats. ISRN dermatology. 2012; 2012(?):346510. doi: 10.5402/2012/346510. [PMID: 22536527]
  • Mi-Young Park, Hoon-Jeong Kwon, Mi-Kyung Sung. Plasma, tissue and urinary levels of aloin in rats after the administration of pure aloin. Nutrition research and practice. 2008; 2(1):17-21. doi: 10.4162/nrp.2008.2.1.17. [PMID: 20126360]
  • Bina S Siddiqui, Fouzia A Sattar, Sabira Begum, Tahsin Gulzar, Fayaz Ahmad. Chemical Constituents from the Stems of Morinda citrifolia Linn. Archives of pharmacal research. 2007 Jul; 30(7):793-8. doi: 10.1007/bf02978826. [PMID: 17703727]
  • Byeoung-Soo Park, Hyun-Kyung Lee, Sung-Eun Lee, Xiang-Lan Piao, Gary R Takeoka, Rosalind Y Wong, Young-Joon Ahn, Jeong-Han Kim. Antibacterial activity of Tabebuia impetiginosa Martius ex DC (Taheebo) against Helicobacter pylori. Journal of ethnopharmacology. 2006 Apr; 105(1-2):255-62. doi: 10.1016/j.jep.2005.11.005. [PMID: 16359837]
  • Man-Yuan Wang, Lan Yang, You-You Tu. [Studies on the chemical constituents from stem of Chirita longgangensis var. Hongyao]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2006 Feb; 31(4):307-8. doi: . [PMID: 16706021]
  • T K Maity, S C Mandal, T Bhakta, M Pal, B P Saha. Metabolism of 1,8-dihydroxy 3-hydroxy methyl anthraquinone (aloe-emodin) isolated from the leaves of Cassia tora in albino rats. Phytotherapy research : PTR. 2001 Aug; 15(5):459-60. doi: 10.1002/ptr.975. [PMID: 11507746]