Aglycone C (BioDeep_00000172653)

   

human metabolite blood metabolite


代谢物信息卡片


8-(1,2-dihydroxyethyl)-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione

化学式: C21H20O8 (400.115812)
中文名称:
谱图信息: 最多检出来源 Bos taurus(endogenous) 80%

分子结构信息

SMILES: COC1=CC=CC2=C1C(=O)C1=C(C(O)=C3CC(O)(CCC3=C1O)C(O)CO)C2=O
InChI: InChI=1S/C21H20O8/c1-29-12-4-2-3-10-14(12)20(27)16-15(18(10)25)19(26)11-7-21(28,13(23)8-22)6-5-9(11)17(16)24/h2-4,13,22-24,26,28H,5-8H2,1H3



数据库引用编号

4 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)

1 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

  • Osama G Mohamed, Akram A Shalabi, Ali M El Halawany, Ashootosh Tripathi, Essam Abdel-Sattar. Hexagonosides A-F: Pregnane glycosides isolated from Caralluma hexagona. Phytochemistry. 2024 Jan; 217(?):113903. doi: 10.1016/j.phytochem.2023.113903. [PMID: 37918619]
  • Christian Siebel, Claudia Lanvers-Kaminsky, Gudrun Würthwein, Georg Hempel, Joachim Boos. Bioanalysis of doxorubicin aglycone metabolites in human plasma samples-implications for doxorubicin drug monitoring. Scientific reports. 2020 10; 10(1):18562. doi: 10.1038/s41598-020-75662-w. [PMID: 33122763]
  • Renyuan Liu, Benwei Su, Feiying Huang, Mei Ru, Hui Zhang, Zhanmin Qin, Yonghua Li, Kaixin Zhu. Identification and analysis of cardiac glycosides in Loranthaceae parasites Taxillus chinensis (DC.) Danser and Scurrula parasitica Linn. and their host Nerium indicum Mill. Journal of pharmaceutical and biomedical analysis. 2019 Sep; 174(?):450-459. doi: 10.1016/j.jpba.2019.05.071. [PMID: 31220703]
  • Kumiko Sakai-Kato, Kunie Nanjo, Toru Kawanishi, Haruhiro Okuda. Rapid and sensitive method for measuring the plasma concentration of doxorubicin and its metabolites. Chemical & pharmaceutical bulletin. 2012; 60(3):391-6. doi: 10.1248/cpb.60.391. [PMID: 22382422]
  • H Richly, M Grubert, M E Scheulen, R A Hilger. Plasma and cellular pharmacokinetics of doxorubicin after intravenous infusion of Caelyx/Doxil in patients with hematological tumors. International journal of clinical pharmacology and therapeutics. 2009 Jan; 47(1):55-7. doi: 10.5414/cpp47055. [PMID: 19203539]
  • Dean E Gray, Dale Messer, Andrew Porter, Brian Hefner, Dama Logan, Roger K Harris, Alice P Clark, Joseph A Algaier, J Diane Overstreet, Cynthia S Smith. Analysis of flavonol aglycones and terpenelactones in Ginkgo biloba extract: A comparison of high-performance thin-layer chromatography and column high-performance liquid chromatography. Journal of AOAC International. 2007 Sep; 90(5):1203-9. doi: . [PMID: 17955963]
  • W H Gotlieb, I Bruchim, G Ben-Baruch, B Davidson, A Zeltser, A Andersen, H Olsen. Doxorubicin levels in the serum and ascites of patients with ovarian cancer. European journal of surgical oncology : the journal of the European Society of Surgical Oncology and the British Association of Surgical Oncology. 2007 Mar; 33(2):213-5. doi: 10.1016/j.ejso.2006.11.006. [PMID: 17174514]
  • Aedin Cassidy. Factors affecting the bioavailability of soy isoflavones in humans. Journal of AOAC International. 2006 Jul; 89(4):1182-8. doi: 10.1093/jaoac/89.4.1182. [PMID: 16915862]
  • D L Johnson, W Majak, M H Benn. Excretion of miserotoxin and detoxification of the aglycone by grasshoppers (Orthoptera: Acrididae). Phytochemistry. 2001 Nov; 58(5):739-42. doi: 10.1016/s0031-9422(01)00310-7. [PMID: 11672738]
  • J van Asperen, O van Tellingen, J H Beijnen. The role of mdr1a P-glycoprotein in the biliary and intestinal secretion of doxorubicin and vinblastine in mice. Drug metabolism and disposition: the biological fate of chemicals. 2000 Mar; 28(3):264-7. doi: NULL. [PMID: 10681369]
  • J van Asperen, O van Tellingen, J H Beijnen. Determination of doxorubicin and metabolites in murine specimens by high-performance liquid chromatography. Journal of chromatography. B, Biomedical sciences and applications. 1998 Aug; 712(1-2):129-43. doi: 10.1016/s0378-4347(98)00165-0. [PMID: 9698235]
  • I K Barker, S M Crawford, A F Fell. Determination of plasma concentrations of epirubicin and its metabolites by high-performance liquid chromatography during a 96-h infusion in cancer chemotherapy. Journal of chromatography. B, Biomedical applications. 1996 Jun; 681(2):323-9. doi: 10.1016/0378-4347(96)00030-8. [PMID: 8811443]
  • N A Dobbs, C J Twelves. Measurement of epidoxorubicin and its metabolites by high-performance liquid chromatography using an advanced automated sample processor. Journal of chromatography. 1991 Dec; 572(1-2):211-7. doi: 10.1016/0378-4347(91)80485-u. [PMID: 1818055]