purpurogallin (BioDeep_00000000660)

 

Secondary id: BioDeep_00000407803

human metabolite PANOMIX_OTCML-2023 blood metabolite


代谢物信息卡片


(6E,8Z)-2,3,4,6-tetrahydroxy-5H-benzo[7]annulen-5-one

化学式: C11H8O5 (220.0371718)
中文名称: 红陪酚, 红倍酚
谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 22.73%

分子结构信息

SMILES: C1=CC2=CC(=C(C(=C2C(=O)C(=C1)O)O)O)O
InChI: InChI=1S/C11H8O5/c12-6-3-1-2-5-4-7(13)10(15)11(16)8(5)9(6)14/h1-4,13,15-16H,(H,12,14)

描述信息

Purpurogallin is a cyclic ketone that is 5H-benzocycloheptene bearing an oxo group at position 5 and hydroxy groups at positions 2, 3, 4 and 6. It has a role as an antibacterial agent, an antioxidant, an EC 1.17.3.2 (xanthine oxidase) inhibitor and a protective agent. It is a tetrol, a cyclic ketone and a member of phenols. It derives from a hydride of a 5H-benzocycloheptene.
Purpurogalline is a natural product found in Quercus with data available.
Purpurogallin is a naturally phenol extracted from the plants of Quercus spp, has potent xanthine oxidase (XO) inhibitory activity with an IC50 of 0.2 μM. Purpurogallin has antioxidant and anti-inflammatory effects[1][2][3].

同义名列表

27 个代谢物同义名

(6E,8Z)-2,3,4,6-tetrahydroxy-5H-benzo[7]annulen-5-one; 2,3,4,6-Tetrahydroxy-5H-benzo[a]cyclohepten-5-one #; 5H-Benzocyclohepten-5-one, 2,3,4,6-tetrahydroxy- [; 2,3,4,6-Tetrahydroxy-5H-benzo[a]cyclohepten-5-one; 2,3,4,5-tetrakis(oxidanyl)benzo[7]annulen-6-one; 2,3,4,6-Tetrahydroxy-5H-benzocycloheptene-5-one; 5H-Benzocyclohepten-5-one,3,4,6-tetrahydroxy-; 2,3,4,6-tetrahydroxy-5H-benzo[7]annulen-5-one; 2,3,4,6-Tetrahydroxybenzocyclohepten-5-one; 2,3,4,5-tetrahydroxybenzocyclohepten-6-one; 2,3,4,5-tetrahydroxy-6-benzo[7]annulenone; 2,3,4,6-tetrahydroxybenzo[7]annulen-5-one; Spectrum3_000692; Spectrum5_000114; Spectrum2_000582; Spectrum4_001547; Hit compound, 2; Purpurogalline; Oprea1_685478; Purpurogallin; DivK1c_006407; KBio3_001663; KBio2_000828; KBio1_001351; KBio2_003396; KBio2_005964; KSC-12-239



数据库引用编号

16 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。



文献列表

  • Yi-Jie Li, Cheng-Ting Xu, Dan-Dan Lin, Jiang-Ke Qin, Gao-Jie Ye, Qing-Hua Deng. Anti-inflammatory polyphenol constituents derived from Cissus pteroclada Hayata. Bioorganic & medicinal chemistry letters. 2016 08; 26(15):3425-8. doi: 10.1016/j.bmcl.2016.06.054. [PMID: 27374242]
  • Yong-Lin Huang, Takaaki Tsujita, Takashi Tanaka, Yosuke Matsuo, Isao Kouno, Dian-Peng Li, Gen-ichiro Nonaka. Triterpene hexahydroxydiphenoyl esters and a quinic acid purpurogallin carbonyl ester from the leaves of Castanopsis fissa. Phytochemistry. 2011 Nov; 72(16):2006-14. doi: 10.1016/j.phytochem.2011.07.007. [PMID: 21831402]
  • Elizabeth A Mazzio, Fran Close, Karam F A Soliman. The biochemical and cellular basis for nutraceutical strategies to attenuate neurodegeneration in Parkinson's disease. International journal of molecular sciences. 2011 Jan; 12(1):506-69. doi: 10.3390/ijms12010506. [PMID: 21340000]
  • Magdalene K Montgomery, A J Hulbert, William A Buttemer. The long life of birds: the rat-pigeon comparison revisited. PloS one. 2011; 6(8):e24138. doi: 10.1371/journal.pone.0024138. [PMID: 21904609]
  • Abdelaziz S Abu El-Saad, Hamada M Mahmoud. Phytic Acid Exposure Alters AflatoxinB1-induced Reproductive and Oxidative Toxicity in Albino Rats (Rattus norvegicus). Evidence-based complementary and alternative medicine : eCAM. 2009 Sep; 6(3):331-41. doi: 10.1093/ecam/nem137. [PMID: 18955247]
  • Akram Jamshidzadeh, Hossein Niknahad, Hamed Kashafi. Cytotoxicity of chloroquine in isolated rat hepatocytes. Journal of applied toxicology : JAT. 2007 Jul; 27(4):322-6. doi: 10.1002/jat.1194. [PMID: 17265541]
  • Yongming Luo, Yiguang Li, Yihui Xie. [Separation and identification of two benzotropolones from teapigment]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials. 2004 Jun; 27(6):410-1. doi: ". [PMID: 15524291]