7-(2-Hydroxyethyl)theophylline (BioDeep_00000275351)

   


代谢物信息卡片


7-(2-Hydroxyethyl)theophylline

化学式: C9H12N4O3 (224.0909362)
中文名称: B-羟乙基茶碱
谱图信息: 最多检出来源 Viridiplantae(plant) 64.71%

分子结构信息

SMILES: Cn1c(=O)c2c(ncn2CCO)n(C)c1=O
InChI: InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3

描述信息

D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents
C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor
CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu); Flow Injection
CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu)

同义名列表

2 个代谢物同义名

7-(2-Hydroxyethyl)theophylline; ETOFYLLINE



数据库引用编号

111 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)

0 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

  • Archit Dahiya, Rajeev Sharma, Abhimanyu Singh, Piyush Joshi, Harsh Wardhan. Role of Etophylline and Theophylline Prolonged Release Tablet in COVID-19 Associated Sinus Node Dysfunction. The Journal of the Association of Physicians of India. 2022 Jan; 70(1):11-12. doi: . [PMID: 35062804]
  • Mark J Henderson, Kathleen A Trychta, Shyh-Ming Yang, Susanne Bäck, Adam Yasgar, Emily S Wires, Carina Danchik, Xiaokang Yan, Hideaki Yano, Lei Shi, Kuo-Jen Wu, Amy Q Wang, Dingyin Tao, Gergely Zahoránszky-Kőhalmi, Xin Hu, Xin Xu, David Maloney, Alexey V Zakharov, Ganesha Rai, Fumihiko Urano, Mikko Airavaara, Oksana Gavrilova, Ajit Jadhav, Yun Wang, Anton Simeonov, Brandon K Harvey. A target-agnostic screen identifies approved drugs to stabilize the endoplasmic reticulum-resident proteome. Cell reports. 2021 04; 35(4):109040. doi: 10.1016/j.celrep.2021.109040. [PMID: 33910017]
  • Tobie D Lee, Olivia W Lee, Kyle R Brimacombe, Lu Chen, Rajarshi Guha, Sabrina Lusvarghi, Bethilehem G Tebase, Carleen Klumpp-Thomas, Robert W Robey, Suresh V Ambudkar, Min Shen, Michael M Gottesman, Matthew D Hall. A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. Molecular pharmacology. 2019 11; 96(5):629-640. doi: 10.1124/mol.119.115964. [PMID: 31515284]
  • Li-Na Fang, Ming-Qing Mao, Xiao-Hua Zhao, Ling Yang, Hui Jia, Shu-Yue Xia. Development and validation of a UPLC-MS/MS method for quantification of doxofylline and its metabolites in human plasma. Journal of pharmaceutical and biomedical analysis. 2019 Sep; 174(?):220-225. doi: 10.1016/j.jpba.2019.05.039. [PMID: 31181483]
  • Nishikant Wase, Boqiang Tu, James W Allen, Paul N Black, Concetta C DiRusso. Identification and Metabolite Profiling of Chemical Activators of Lipid Accumulation in Green Algae. Plant physiology. 2017 Aug; 174(4):2146-2165. doi: 10.1104/pp.17.00433. [PMID: 28652262]
  • Emmy Tuenter, Rizwan Ahmad, Kenn Foubert, Adnan Amin, Maria Orfanoudaki, Paul Cos, Louis Maes, Sandra Apers, Luc Pieters, Vassiliki Exarchou. Isolation and Structure Elucidation by LC-DAD-MS and LC-DAD-SPE-NMR of Cyclopeptide Alkaloids from the Roots of Ziziphus oxyphylla and Evaluation of Their Antiplasmodial Activity. Journal of natural products. 2016 11; 79(11):2865-2872. doi: 10.1021/acs.jnatprod.6b00633. [PMID: 27933893]
  • Waqar Ahmad Kaleem, Naveed Muhammad, Mughal Qayum, Haroon Khan, Abad Khan, Luigi Aliberti, Vincenzo De Feo. Antinociceptive activity of cyclopeptide alkaloids isolated from Ziziphus oxyphylla Edgew (Rhamnaceae). Fitoterapia. 2013 Dec; 91(?):154-158. doi: 10.1016/j.fitote.2013.08.024. [PMID: 24013037]
  • Susruta Majumdar, Maren Mueller-Spaeth, Kenneth B Sloan. Prodrugs of theophylline incorporating ethyleneoxy groups in the promoiety: synthesis, characterization, and transdermal delivery. AAPS PharmSciTech. 2012 Sep; 13(3):853-62. doi: 10.1208/s12249-012-9803-6. [PMID: 22648150]
  • Waqar Ahmad Kaleem, Muhammad Nisar, Mughal Qayum, Muhammad Zia-Ul-Haq, Achyut Adhikari, Vincenzo De Feo. New 14-membered cyclopeptide alkaloids from Zizyphus oxyphylla Edgew. International journal of molecular sciences. 2012; 13(9):11520-11529. doi: 10.3390/ijms130911520. [PMID: 23109868]
  • Ramakrishna V S Nirogi, Vishwottam N Kandikere, Manoj Shukla, Koteshwara Mudigonda, Devender R Ajjala. A simple and rapid HPLC/UV method for the simultaneous quantification of theophylline and etofylline in human plasma. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences. 2007 Apr; 848(2):271-6. doi: 10.1016/j.jchromb.2006.10.035. [PMID: 17110179]
  • Toshihiro Kitahashi, Itaru Furuta. Method development for determining the antibacterial linezolid in human serum by micellar electrokinetic capillary chromatography. Journal of pharmaceutical and biomedical analysis. 2002 Nov; 30(4):1411-6. doi: 10.1016/s0731-7085(02)00475-2. [PMID: 12408933]
  • Soon-Ai Kim, Melissa A Marshall, Neli Melman, Hak Sung Kim, Christa E Müller, Joel Linden, Kenneth A Jacobson. Structure-activity relationships at human and rat A2B adenosine receptors of xanthine derivatives substituted at the 1-, 3-, 7-, and 8-positions. Journal of medicinal chemistry. 2002 May; 45(11):2131-8. doi: 10.1021/jm0104318. [PMID: 12014951]
  • Michael Kress, Dieane Meissner, Patricia Kaiser, Rainer Hanke, William Graham Wood. Determination of theophylline by HPLC and GC-IDMS, the effect of chemically similar xanthine derivatives on the specificity of the method and the possibility of paracetamol as interfering substance. Clinical laboratory. 2002; 48(9-10):541-51. doi: . [PMID: 12389716]
  • A De Sarro, S Grasso, M Zappala, F Nava, G De Sarro. Convulsant effects of some xanthine derivatives in genetically epilepsy-prone rats. Naunyn-Schmiedeberg's archives of pharmacology. 1997 Jul; 356(1):48-55. doi: 10.1007/pl00005027. [PMID: 9228189]
  • S Gupta, R K Raina, K Samotra, K L Gupta. Pharmacokinetics of sustained release and conventional tablets of theophylline plus hydroxyethyltheophylline and its comparison with tablet aminophylline. The Indian journal of chest diseases & allied sciences. 1991 Jan; 33(1):1-8. doi: NULL. [PMID: 1791015]
  • A Lagana, M Bizzarri, A Marino, M Mancini. Solid phase extraction and high performance liquid chromatographic determination of doxophylline in plasma. Biomedical chromatography : BMC. 1990 Sep; 4(5):205-7. doi: 10.1002/bmc.1130040507. [PMID: 2279147]
  • R Delport, J B Ubbink, H Bosman, S Bissbort, W J Vermaak. Altered vitamin B6 homeostasis during aminophylline infusion in the beagle dog. International journal for vitamin and nutrition research. Internationale Zeitschrift fur Vitamin- und Ernahrungsforschung. Journal international de vitaminologie et de nutrition. 1990; 60(1):35-40. doi: NULL. [PMID: 2387668]
  • M I Arranz Peña, E Saenz Lope. Rapid gas-chromatographic microdetermination of soluphylline in serum. Journal of clinical chemistry and clinical biochemistry. Zeitschrift fur klinische Chemie und klinische Biochemie. 1988 Nov; 26(11):791-3. doi: NULL. [PMID: 3235955]
  • M V Alvarez, A Ceballos, F Gonzalez Velasco, J M Cachaza, E L Mariño. Binding of theophylline, ethophylline and diprophylline to human serum albumin. Il Farmaco; edizione pratica. 1988 Jul; 43(7-8):259-65. doi: NULL. [PMID: 3234537]
  • K Svedmyr, T Mellstrand, N Svedmyr. Bioavailability of theophylline from three different tablets in asthmatic patients and their bronchodilating effects in combination with terbutaline inhalation. Allergy. 1982 Feb; 37(2):111-7. doi: 10.1111/j.1398-9995.1982.tb01884.x. [PMID: 7137520]
  • B Král, M Tichý, J Eliás, J Simsa, P Tilser, S Jezek, M Pleskot. [Serum concentrations of theophylline in different techniques of treatment with its derivatives (author's transl)]. Casopis lekaru ceskych. 1981 Oct; 120(42):1287-90. doi: NULL. [PMID: 7344805]
  • J G Ufkes, R S Leeuwin, M Ottenhof, A Zeegers, J Zuidema. Efficacy of theophylline and its N-7-substituted derivatives in experimentally induced bronchial asthma in the guinea-pig. Archives internationales de pharmacodynamie et de therapie. 1981 Oct; 253(2):301-14. doi: . [PMID: 7325766]
  • J Zuidema, J Verhoeven, F W Merkus. Pharmacokinetics of etofylline after intravenous and oral administration to humans. International journal of clinical pharmacology, therapy, and toxicology. 1981 Jul; 19(7):310-3. doi: NULL. [PMID: 7263108]
  • D Kandt, I Sehrt, H Iwainsky. [Application of theophylline as an inhalant (author's transl)]. Zeitschrift fur Erkrankungen der Atmungsorgane. 1981 May; 157(2):152-9. doi: NULL. [PMID: 7314689]
  • W Erking, P W Lücker, G Niebch, K Thiemer, K Wetzelsberger. [Human pharmacokinetics of theophylline and etofylline from different formulations of a cardiotonic (author's transl)]. Arzneimittel-Forschung. 1981; 31(2):371-9. doi: NULL. [PMID: 7194656]