AIDS-097062 (BioDeep_00000866695)

Main id: BioDeep_00000413154

 

PANOMIX_OTCML-2023 Antitumor activity


代谢物信息卡片


Methyl-3-methylorsellinate; Methyl beta-orcinolcarboxylate; Evernyl; Atraric acid;

化学式: C10H12O4 (196.0736)
中文名称: 橡苔, 2,4-二羟基-3,6-二甲基苯甲酸甲酯
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1=CC(=C(C(=C1C(=O)OC)O)C)O
InChI: InChI=1S/C10H12O4/c1-5-4-7(11)6(2)9(12)8(5)10(13)14-3/h4,11-12H,1-3H3

描述信息

Atraric acid (Methyl atrarate) is a specific androgen receptor (AR) antagonist with anti-inflammatory and anticancer effects. Atraric acid represses the expression of the endogenous prostate specific antigen gene in both LNCaP and C4-2 cells. Atraric acid can also inhibit the synthesis of NO and cytokine, and suppress the MAPK-NFκB signaling pathway. Atraric acid can be used to research prostate diseases and inflammatory diseases[1][2].
Atraric acid (Methyl atrarate) is a specific androgen receptor (AR) antagonist with anti-inflammatory and anticancer effects. Atraric acid represses the expression of the endogenous prostate specific antigen gene in both LNCaP and C4-2 cells. Atraric acid can also inhibit the synthesis of NO and cytokine, and suppress the MAPK-NFκB signaling pathway. Atraric acid can be used to research prostate diseases and inflammatory diseases[1][2].

同义名列表

26 个代谢物同义名

Methyl-3-methylorsellinate; Methyl beta-orcinolcarboxylate; Evernyl; Atraric acid;; Benzoic acid, 2,4-dihydroxy-3,6-dimethyl-, methyl ester; 2,4-DIHYDROXY-3,6-DIMETHYL-BENZOIC ACID METHYL ESTER; 2,4-dihydroxy-3,6-dimethylbenzoic acid methyl ester; .beta.-Resorcylic acid, 3,6-dimethyl-, methyl ester; beta-Resorcyclic acid, 3,6-dimethyl-, methyl ester; beta-Resorcylic acid, 3,6-dimethyl-, methyl ester; methyl 2,4-dihydroxy-3,6-dimethyl-benzoate; Methyl 2,4-dihydroxy-3,6-dimethylbenzoate; Methyl beta-orcinolcarboxylate; Methyl 3,6-dimethylresorcylate; EINECS 225-193-0; Methyl atratate; W523305_ALDRICH; CBDivE_016254; MLS000517295; ZINC00239015; SMR000127412; AIDS-097062; 136218-95-6; AIDS097062; ST5408246; 4707-47-5; Methyl atrarate; Atraric acid; Methyl 2,4-dihydroxy-3,6-dimethylbenzoate



数据库引用编号

6 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)

3 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。

亚细胞结构定位 关联基因列表


文献列表

  • Seul-Ki Mun, Kyung-Yun Kang, Ho-Yeol Jang, Yun-Ho Hwang, Seong-Gyeol Hong, Su-Jin Kim, Hyun-Wook Cho, Dong-Jo Chang, Jae-Seoun Hur, Sung-Tae Yee. Atraric Acid Exhibits Anti-Inflammatory Effect in Lipopolysaccharide-Stimulated RAW264.7 Cells and Mouse Models. International journal of molecular sciences. 2020 Sep; 21(19):. doi: 10.3390/ijms21197070. [PMID: 32992840]
  • Yoshinori Asakawa, Agnieszka Ludwiczuk. Chemical Constituents of Bryophytes: Structures and Biological Activity. Journal of natural products. 2018 03; 81(3):641-660. doi: 10.1021/acs.jnatprod.6b01046. [PMID: 29019405]
  • Mayurika Goel, Prem Dureja, Archna Rani, Prem L Uniyal, Hartmut Laatsch. Isolation, characterization and antifungal activity of major constituents of the Himalayan lichen Parmelia reticulata Tayl. Journal of agricultural and food chemistry. 2011 Mar; 59(6):2299-307. doi: 10.1021/jf1049613. [PMID: 21351753]
  • Daniela Roell, Aria Baniahmad. The natural compounds atraric acid and N-butylbenzene-sulfonamide as antagonists of the human androgen receptor and inhibitors of prostate cancer cell growth. Molecular and cellular endocrinology. 2011 Jan; 332(1-2):1-8. doi: 10.1016/j.mce.2010.09.013. [PMID: 20965230]
  • Charles Mutai, Dennis Abatis, Constantinos Vagias, Dimitri Moreau, Christos Roussakis, Vassilios Roussis. Lupane triterpenoids from Acacia mellifera with cytotoxic activity. Molecules (Basel, Switzerland). 2007 May; 12(5):1035-44. doi: 10.3390/12051035. [PMID: 17873838]
  • Sonja Schleich, Maria Papaioannou, Aria Baniahmad, Rudolf Matusch. Activity-guided isolation of an antiandrogenic compound of Pygeum africanum. Planta medica. 2006 May; 72(6):547-51. doi: 10.1055/s-2006-941472. [PMID: 16773539]
  • Rainer Gormann, Maki Kaloga, Xing-Cong Li, Daneel Ferreira, Dieter Bergenthal, Herbert Kolodziej. Furanonaphthoquinones, atraric acid and a benzofuran from the stem barks of Newbouldia laevis. Phytochemistry. 2003 Sep; 64(2):583-7. doi: 10.1016/s0031-9422(03)00277-2. [PMID: 12943779]
  • Naheed Riaz, Itrat Anis, Pir Muhammad Khan, Raza Shah, Abdul Malik. Alysinol--a new triterpene from Alysicarpus monolifer. Natural product letters. 2002 Dec; 16(6):415-8. doi: 10.1080/10575630290034258. [PMID: 12462347]
  • L Acevedo, E Martínez, P Castañeda, S Franzblau, B N Timmermann, E Linares, R Bye, R Mata. New phenylethanoids from Buddleja cordata subsp. cordata. Planta medica. 2000 Apr; 66(3):257-61. doi: 10.1055/s-2000-8570. [PMID: 10821053]
  • K C Kumar, K Müller. Lichen metabolites. 2. Antiproliferative and cytotoxic activity of gyrophoric, usnic, and diffractaic acid on human keratinocyte growth. Journal of natural products. 1999 Jun; 62(6):821-3. doi: 10.1021/np980378z. [PMID: 10395495]
  • K C Kumar, K Müller. Lichen metabolites. 1. Inhibitory action against leukotriene B4 biosynthesis by a non-redox mechanism. Journal of natural products. 1999 Jun; 62(6):817-20. doi: 10.1021/np9803777. [PMID: 10395494]