IJ-5 compound (BioDeep_00000395595)

Main id: BioDeep_00000022428

 

PANOMIX_OTCML-2023


代谢物信息卡片


Naphtho[2,3-b]furan-2(3H)-one, 3a,5,6,7,8,8a,9,9a-octahydro-8-hydroxy-5,8a-dimethyl-3-methylene-, [3aR-(3aalpha,5beta,8beta,8abeta,9aalpha)]-

化学式: C15H20O3 (248.14123700000002)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1CCC(C2(C1=CC3C(C2)OC(=O)C3=C)C)O
InChI: InChI=1S/C15H20O3/c1-8-4-5-13(16)15(3)7-12-10(6-11(8)15)9(2)14(17)18-12/h6,8,10,12-13,16H,2,4-5,7H2,1,3H3/t8-,10+,12+,13+,15+/m0/s1

描述信息

1beta-Hydroxyalantolactone is a sesquiterpene lactone.
1beta-Hydroxyalantolactone is a natural product found in Pentanema britannicum, Inula japonica, and Inula helenium with data available.
1beta-Hydroxyalantolactone modulate many processes that influence inflammatory reactions[1].
1beta-Hydroxyalantolactone modulate many processes that influence inflammatory reactions[1].

同义名列表

11 个代谢物同义名

Naphtho[2,3-b]furan-2(3H)-one, 3a,5,6,7,8,8a,9,9a-octahydro-8-hydroxy-5,8a-dimethyl-3-methylene-, [3aR-(3aalpha,5beta,8beta,8abeta,9aalpha)]-; Naphtho[2,3-b]furan-2(3H)-one, 3a,5,6,7,8,8a,9,9a-octahydro-8-hydroxy-5,8a-dimethyl-3-methylene-, (3aR,5S,8R,8aR,9aR)-; (3aR,5S,8R,8aR,9aR)-3a,5,6,7,8,8a,9,9a-Octahydro-8-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one; (3aR,5S,8R,8aR,9aR)-8-hydroxy-5,8a-dimethyl-3-methylidene-5,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one; (3aR,5S,8R,8aR,9aR)-8-hydroxy-5,8a-dimethyl-3-methylidene-5,6,7,8,9,9a-hexahydro-3aH-benzo[][1]benzouran-2-one; Hydroxyalantolactone, 1beta-; 1beta-Hydroxyalantolactone; 1-hydroxyalantolactone; IJ-5 compound; GWC62NA7PP; IJ-5



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)

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

  • Bing Yu, Xiao-Qing Jin, Wen-Ying Yu, Ying-Ying Dong, Hua-Zhong Ying, Chen-Huan Yu. 1β-Hydroxyalantolactone from Inulae Flos alleviated the progression of pulmonary fibrosis via inhibiting JNK/FOXO1/NF-κB pathway. International immunopharmacology. 2021 Dec; 101(Pt A):108339. doi: 10.1016/j.intimp.2021.108339. [PMID: 34758440]
  • Youdong Xu, Xianli Meng. Molecular Simulation Elaborating the Mechanism of 1β-Hydroxy Alantolactone Inhibiting Ubiquitin-Conjugating Enzyme UbcH5s. Scientific reports. 2020 01; 10(1):141. doi: 10.1038/s41598-019-57104-4. [PMID: 31924820]
  • Jiang-Jiang Tang, Qiu-Rui He, Shuai Dong, Xin Guo, Yu-Gong Wang, Bei-Lei Lei, Jun-Mian Tian, Jin-Ming Gao. Diversity Modification and Structure-Activity Relationships of Two Natural Products 1β-hydroxy Alantolactone and Ivangustin as Potent Cytotoxic Agents. Scientific reports. 2018 01; 8(1):1722. doi: 10.1038/s41598-018-20192-9. [PMID: 29379131]
  • Hao Chen, Guozhen Wu, Shuang Gao, Ruihua Guo, Zeng Zhao, Hu Yuan, Shanxiang Liu, Jian Wu, Xiaolong Lu, Xing Yuan, Zongmin Yu, Xianpeng Zu, Ning Xie, Niao Yang, Zhenlin Hu, Qingyan Sun, Weidong Zhang. Discovery of Potent Small-Molecule Inhibitors of Ubiquitin-Conjugating Enzyme UbcH5c from α-Santonin Derivatives. Journal of medicinal chemistry. 2017 08; 60(16):6828-6852. doi: 10.1021/acs.jmedchem.6b01829. [PMID: 28696694]
  • Lin-fen Ding, Kou Wang, Hai-yin Wang, Wen-chao Tu, Zhen-tao Deng, Yue Zhou, Liu-dong Song. [Chemical Constituents of Inula japonica]. Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials. 2016 Jun; 39(6):1296-9. doi: . [PMID: 30156801]
  • Guochao Lin, Shuang Gao, Jinli Cheng, Yinghua Li, Lei Shan, Zhenlin Hu. 1β-Hydroxyalantolactone, a sesquiterpene lactone from Inula japonica, attenuates atopic dermatitis-like skin lesions induced by 2,4-dinitrochlorobenzene in the mouse. Pharmaceutical biology. 2016; 54(3):516-22. doi: 10.3109/13880209.2015.1050745. [PMID: 26017682]