Nalbuphine sebacate (BioDeep_00000838797)
代谢物信息卡片
化学式: C52H68N2O10 (880.4873708000001)
中文名称:
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: C1CC(C1)CN2CCC34C5C(CCC3(C2CC6=C4C(=C(C=C6)OC(=O)CCCCCCCCC(=O)OC7=C8C9=C(CC1C2(C9(CCN1CC1CCC1)C(O8)C(CC2)O)O)C=C7)O5)O)O
InChI: InChI=1S/C52H68N2O10/c55-35-19-21-51(59)39-27-33-15-17-37(45-43(33)49(51,47(35)63-45)23-25-53(39)29-31-9-7-10-31)61-41(57)13-5-3-1-2-4-6-14-42(58)62-38-18-16-34-28-40-52(60)22-20-36(56)48-50(52,44(34)46(38)64-48)24-26-54(40)30-32-11-8-12-32/h15-18,31-32,35-36,39-40,47-48,55-56,59-60H,1-14,19-30H2/t35-,36-,39+,40+,47-,48-,49-,50-,51+,52+/m0/s1
描述信息
D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids
同义名列表
1 个代谢物同义名
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代谢反应
0 个相关的代谢反应过程信息。
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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
- Shang-Wen Lin, Yan-Jye Shyong, Ping-Chung Kuo, Jui-Chen Tsai. Topical application of sebacoyl dinalbuphine ester-loaded nanostructured lipid carriers alleviate pruritus in scratching mouse model.
International journal of pharmaceutics.
2021 May; 600(?):120400. doi:
10.1016/j.ijpharm.2021.120400. [PMID: 33636328] - Pei-Wei Huang, Hung-Ta Liu, Cheng-Huei Hsiong, Li-Heng Pao, Chih-Cherng Lu, Shung-Tai Ho, Oliver Yoa-Pu Hu. Simultaneous determination of nalbuphine and its prodrug sebacoly dinalbuphine ester in human plasma by ultra-performance liquid chromatography-tandem mass spectrometry and its application to pharmacokinetic study in humans.
Biomedical chromatography : BMC.
2013 Jul; 27(7):831-7. doi:
10.1002/bmc.2867. [PMID: 23460034] - I Massarelli, M Macchia, F Minutolo, G Prota, A M Bianucci. QSAR models for predicting enzymatic hydrolysis of new chemical entities in 'soft-drug' design.
Bioorganic & medicinal chemistry.
2009 May; 17(10):3543-56. doi:
10.1016/j.bmc.2009.04.014. [PMID: 19398207] - Li-Heng Pao, Cheng-Huei Hsiong, Oliver Yoa-Pu Hu, Jhi-Jung Wang, Shung-Tai Ho. In vitro and in vivo evaluation of the metabolism and pharmacokinetics of sebacoyl dinalbuphine.
Drug metabolism and disposition: the biological fate of chemicals.
2005 Mar; 33(3):395-402. doi:
10.1124/dmd.104.002451. [PMID: 15608131] - L H Pao, C H Hsiong, O Y Hu, S T Ho. High-performance liquid chromatographic method for the simultaneous determination of nalbuphine and its prodrug, sebacoyl dinalbuphine ester, in dog plasma and application to pharmacokinetic studies in dogs.
Journal of chromatography. B, Biomedical sciences and applications.
2000 Sep; 746(2):241-7. doi:
10.1016/s0378-4347(00)00326-1. [PMID: 11076077]