Benzoylhypaconine (BioDeep_00000176584)
Main id: BioDeep_00000230443
human metabolite PANOMIX_OTCML-2023 blood metabolite
代谢物信息卡片
化学式: C31H43NO9 (573.2937668000001)
中文名称: 苯甲酰次乌头原碱
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CN1CC2(CCC(C34C2C(C(C31)C5(C6C4CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)O)OC)OC)COC
InChI: InChI=1S/C31H43NO9/c1-32-14-28(15-37-2)12-11-18(38-3)30-17-13-29(35)25(41-27(34)16-9-7-6-8-10-16)19(17)31(36,24(33)26(29)40-5)20(23(30)32)21(39-4)22(28)30/h6-10,17-26,33,35-36H,11-15H2,1-5H3
描述信息
Benzoylhypaconine (Benzoylhypacoitine) is a monoester Aconitum alkaloid, is the main pharmacologic and toxic component[1].
Benzoylhypaconine (Benzoylhypacoitine) is a monoester Aconitum alkaloid, is the main pharmacologic and toxic component[1].
同义名列表
4 个代谢物同义名
5,7,8-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.1^{2,5}.0^{1,10}.0^{3,8}.0^{13,17}]nonadecan-4-yl benzoate; [5,7,8-Trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate; Benzoylhypaconine; Benzoylhypacoitine
数据库引用编号
5 个数据库交叉引用编号
- PubChem: 13343336
- HMDB: HMDB0249052
- chemspider: 13756785
- CAS: 63238-66-4
- medchemexpress: HY-N0850
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)
2 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
- Jian Wu, Ying Xie, Zheng Xiang, Canjian Wang, Hua Zhou, Liang Liu. Simultaneous Determination of Multiple Components in Guanjiekang in Rat Plasma via the UPLC-MS/MS Method and Its Application in Pharmacokinetic Study.
Molecules (Basel, Switzerland).
2016 Dec; 21(12):. doi:
10.3390/molecules21121732. [PMID: 27999285] - Shuai Song, Qingfa Tang, Huiling Huo, Hancheng Li, Xuefeng Xing, Jiabo Luo. Simultaneous quantification and pharmacokinetics of alkaloids in Herba Ephedrae-Radix Aconiti Lateralis extracts.
Journal of analytical toxicology.
2015 Jan; 39(1):58-68. doi:
10.1093/jat/bku113. [PMID: 25324527] - Wen-Wen Peng, Wen Li, Jun-Song Li, Xiao-Bing Cui, Yong-xin Zhang, Guang-Ming Yang, Hong-Mei Wen, Bao-Chang Cai. The effects of Rhizoma Zingiberis on pharmacokinetics of six Aconitum alkaloids in herb couple of Radix Aconiti Lateralis-Rhizoma Zingiberis.
Journal of ethnopharmacology.
2013 Jul; 148(2):579-86. doi:
10.1016/j.jep.2013.04.056. [PMID: 23707213] - Qian Wang, Rong Shi, Yue-Ming Ma, Peng Jiang, Jie Zhong, Hong-Yan Cui, Ping Liu, Cheng-Hai Liu. Content determination of the major constituents of Yinchenzhufu decoction via ultra high-performance liquid chromatography coupled with electrospray ionisation tandem mass spectrometry.
Journal of pharmaceutical and biomedical analysis.
2013 Apr; 77(?):88-93. doi:
10.1016/j.jpba.2013.01.020. [PMID: 23411001] - Rui-Qing Wen, Dong-Hui Li, Xin Zhao, Jia-Bo Wang, Yan-Ling Zhao, Ping Zhang, Zhi-Yong Sun, Dan Yan, Xiao-He Xiao, Yu-Zhen Ren, Fei Li, Jie Du, Hai-Yan Zhou. [Rationality of the processing methods of aconiti lateralis radix (Fuzi) based on chemical analysis].
Yao xue xue bao = Acta pharmaceutica Sinica.
2013 Feb; 48(2):286-90. doi:
". [PMID: 23672028] - Ping Cui, Han Han, Rui Wang, Li Yang. Identification and determination of Aconitum alkaloids in Aconitum herbs and Xiaohuoluo pill using UPLC-ESI-MS.
Molecules (Basel, Switzerland).
2012 Aug; 17(9):10242-57. doi:
10.3390/molecules170910242. [PMID: 22926305] - Jing-Zheng Song, Quan-Bin Han, Chun-Feng Qiao, Paul Pui-Hay But, Hong-Xi Xu. Development and validation of a rapid capillary zone electrophoresis method for the determination of aconite alkaloids in aconite roots.
Phytochemical analysis : PCA.
2010 Mar; 21(2):137-43. doi:
10.1002/pca.1168. [PMID: 19810124] - Fan Zhang, Ming-Hai Tang, Li-Juan Chen, Rui Li, Xian-Huo Wang, Jun-Guo Duan, Xia Zhao, Yu-Quan Wei. Simultaneous quantitation of aconitine, mesaconitine, hypaconitine, benzoylaconine, benzoylmesaconine and benzoylhypaconine in human plasma by liquid chromatography-tandem mass spectrometry and pharmacokinetics evaluation of "SHEN-FU" injectable powder.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences.
2008 Oct; 873(2):173-9. doi:
10.1016/j.jchromb.2008.08.008. [PMID: 18778973] - Makiko Hayashida, Hideyuki Hayakawa, Kentaro Wada, Takeshi Yamada, Makoto Nihira, Youkichi Ohno. A column-switching LC/MS/ESI method for detecting tetrodotoxin and Aconitum alkaloids in serum.
Legal medicine (Tokyo, Japan).
2003 Mar; 5 Suppl 1(?):S101-4. doi:
10.1016/s1344-6223(02)00076-7. [PMID: 12935563]