Didesethyl Chloroquine (BioDeep_00000176739)

   

human metabolite blood metabolite


代谢物信息卡片


N4-(7-chloroquinolin-4-yl)pentane-1,4-diamine

化学式: C14H18ClN3 (263.1189178)
中文名称:
谱图信息: 最多检出来源 Homo sapiens(blood) 5.56%

分子结构信息

SMILES: CC(CCCN)NC1=C2C=CC(=CC2=NC=C1)Cl
InChI: InChI=1S/C14H18ClN3/c1-10(3-2-7-16)18-13-6-8-17-14-9-11(15)4-5-12(13)14/h4-6,8-10H,2-3,7,16H2,1H3,(H,17,18)

描述信息

同义名列表

9 个代谢物同义名

N4-(7-chloroquinolin-4-yl)pentane-1,4-diamine; N,N-Dideethylchloroquine sulfate; N,N-Dideethylchloroquine; Bi(deethyl)chloroquine; Bisdesethylchloroquine; Didesethyl Chloroquine; Bisdeethylchloroquine; Didesethylchloroquine; CQMM



数据库引用编号

5 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

  • Vong Sok, Florence Marzan, David Gingrich, Francesca Aweeka, Liusheng Huang. Development and validation of an LC-MS/MS method for determination of hydroxychloroquine, its two metabolites, and azithromycin in EDTA-treated human plasma. PloS one. 2021; 16(3):e0247356. doi: 10.1371/journal.pone.0247356. [PMID: 33667247]
  • Ako Koreeda, Kosei Yonemitsu, Hiroe Kohmatsu, Sohtaro Mimasaka, Yuki Ohtsu, Toru Oshima, Kunio Fujiwara, Shigeyuki Tsunenari. Immunohistochemical demonstration of the distribution of chloroquine (CQ) and its metabolites in CQ-poisoned mice. Archives of toxicology. 2007 Jul; 81(7):471-8. doi: 10.1007/s00204-007-0185-6. [PMID: 17593411]
  • J F Chaulet, Y Robet, J M Prevosto, O Soares, J L Brazier. Simultaneous determination of chloroquine and quinine in human biological fluids by high-performance liquid chromatography. Journal of chromatography. 1993 Apr; 613(2):303-10. doi: 10.1016/0378-4347(93)80146-u. [PMID: 8491817]
  • H Fieger, J Iredale, I W Wainer. Enantioselective determination of hydroxychloroquine and its major metabolites in urine and the observation of a reversal in the (+)/(-)-hydroxychloroquine ratio. Chirality. 1993; 5(2):65-70. doi: 10.1002/chir.530050205. [PMID: 8343344]
  • J Iredale, I W Wainer. Determination of hydroxychloroquine and its major metabolites in plasma using sequential achiral-chiral high-performance liquid chromatography. Journal of chromatography. 1992 Jan; 573(2):253-8. doi: 10.1016/0378-4347(92)80126-b. [PMID: 1601957]
  • D R Miller, S K Khalil, G A Nygard. Steady-state pharmacokinetics of hydroxychloroquine in rheumatoid arthritis patients. DICP : the annals of pharmacotherapy. 1991 Dec; 25(12):1302-5. doi: 10.1177/106002809102501202. [PMID: 1815421]
  • C Escande, P Chevalier, F Verdier, R Bourdon. Sensitive radioimmunoassay and enzyme-linked immunosorbent assay for the simultaneous determination of chloroquine and its metabolites in biological fluids. Journal of pharmaceutical sciences. 1990 Jan; 79(1):23-7. doi: 10.1002/jps.2600790107. [PMID: 2313570]
  • F O Ajayi, L A Salako, J O Kuye. Comparison of the partitioning in vitro of chloroquine and its desethyl metabolites between the erythrocytes and plasma of healthy subjects and those with falciparum malaria. African journal of medicine and medical sciences. 1989 Jun; 18(2):95-100. doi: NULL. [PMID: 2547293]
  • L A Salako, F O Ajayi. Distribution and urinary excretion of the desethylmetabolites of chloroquine in the rat. The Journal of pharmacy and pharmacology. 1987 Oct; 39(10):859-60. doi: 10.1111/j.2042-7158.1987.tb05136.x. [PMID: 2891831]
  • R R Brown, R M Stroshane, D P Benziger. High-performance liquid chromatographic assay for hydroxychloroquine and three of its major metabolites, desethylhydroxychloroquine, desethylchloroquine and bidesethylchloroquine, in human plasma. Journal of chromatography. 1986 Apr; 377(?):454-9. doi: 10.1016/s0378-4347(00)80809-9. [PMID: 3711242]
  • Y Bergqvist, S Eckerbom. An improved gas chromatographic method for the simultaneous determination of chloroquine and two metabolites using capillary columns. Journal of chromatography. 1984 Mar; 306(?):147-53. doi: 10.1016/s0378-4347(00)80877-4. [PMID: 6715455]