Squalamine (BioDeep_00000011434)
natural product
代谢物信息卡片
化学式: C34H65N3O5S (627.4645)
中文名称: 角鲨胺
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: CC(C)C(CCC(C)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)NCCCNCCCCN)C)O)C)OS(=O)(=O)O
InChI: InChI=1S/C34H65N3O5S/c1-23(2)31(42-43(39,40)41)12-9-24(3)27-10-11-28-32-29(14-16-34(27,28)5)33(4)15-13-26(21-25(33)22-30(32)38)37-20-8-19-36-18-7-6-17-35/h23-32,36-38H,6-22,35H2,1-5H3,(H,39,40,41)/t24-,25-,26+,27-,28+,29+,30-,31-,32+,33+,34-/m1/s1
描述信息
C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C2143 - Endothelial Cell Inhibitor
D006133 - Growth Substances > D043924 - Angiogenesis Modulating Agents
D000970 - Antineoplastic Agents > D020533 - Angiogenesis Inhibitors
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents
D020011 - Protective Agents > D016588 - Anticarcinogenic Agents
D006133 - Growth Substances > D006131 - Growth Inhibitors
同义名列表
数据库引用编号
16 个数据库交叉引用编号
- ChEBI: CHEBI:80765
- KEGG: C16841
- PubChem: 72495
- PubChem: 17981914
- Metlin: METLIN71380
- DrugBank: DB06461
- ChEMBL: CHEMBL444929
- LipidMAPS: LMST05050024
- KNApSAcK: C00029041
- CAS: 148717-90-2
- PMhub: MS000025429
- PubChem: 96023365
- NIKKAJI: J791.550K
- RefMet: Squalamine
- KNApSAcK: 80765
- LOTUS: LTS0189208
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)
12 个相关的物种来源信息
- 7777 - Chondrichthyes: LTS0189208
- 7711 - Chordata: LTS0189208
- 7778 - Elasmobranchii: LTS0189208
- 2759 - Eukaryota: LTS0189208
- 33208 - Metazoa: LTS0189208
- 30511 - Squalidae: LTS0189208
- 7796 - Squalus: LTS0189208
- 7797 - Squalus acanthias:
- 7797 - Squalus acanthias: 10.1021/NP990514F
- 7797 - Squalus acanthias: 10.1073/PNAS.90.4.1354
- 7797 - Squalus acanthias: LTS0189208
- 335062 - Squalus megalops: 10.1073/PNAS.90.4.1354
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
- Michele Perni, Céline Galvagnion, Alexander Maltsev, Georg Meisl, Martin B D Müller, Pavan K Challa, Julius B Kirkegaard, Patrick Flagmeier, Samuel I A Cohen, Roberta Cascella, Serene W Chen, Ryan Limbocker, Pietro Sormanni, Gabriella T Heller, Francesco A Aprile, Nunilo Cremades, Cristina Cecchi, Fabrizio Chiti, Ellen A A Nollen, Tuomas P J Knowles, Michele Vendruscolo, Adriaan Bax, Michael Zasloff, Christopher M Dobson. A natural product inhibits the initiation of α-synuclein aggregation and suppresses its toxicity.
Proceedings of the National Academy of Sciences of the United States of America.
2017 02; 114(6):E1009-E1017. doi:
10.1073/pnas.1610586114. [PMID: 28096355] - Alexander S Maltsev, Alexander Grishaev, Julien Roche, Michael Zasloff, Ad Bax. Improved cross validation of a static ubiquitin structure derived from high precision residual dipolar couplings measured in a drug-based liquid crystalline phase.
Journal of the American Chemical Society.
2014 Mar; 136(10):3752-5. doi:
10.1021/ja4132642. [PMID: 24568736] - Eric Di Pasquale, Chanaz Salmi-Smail, Jean-Michel Brunel, Patrick Sanchez, Jacques Fantini, Marc Maresca. Biophysical studies of the interaction of squalamine and other cationic amphiphilic molecules with bacterial and eukaryotic membranes: importance of the distribution coefficient in membrane selectivity.
Chemistry and physics of lipids.
2010 Feb; 163(2):131-40. doi:
10.1016/j.chemphyslip.2009.10.006. [PMID: 19883637] - Chanaz Salmi, Celine Loncle, Nicolas Vidal, Yves Letourneux, Jacques Fantini, Marc Maresca, Nadira Taïeb, Jean-Marie Pagès, Jean Michel Brunel. Squalamine: an appropriate strategy against the emergence of multidrug resistant gram-negative bacteria?.
PloS one.
2008 Jul; 3(7):e2765. doi:
10.1371/journal.pone.0002765. [PMID: 18648511] - R Scott Obach, Franco Lombardo, Nigel J Waters. Trend analysis of a database of intravenous pharmacokinetic parameters in humans for 670 drug compounds.
Drug metabolism and disposition: the biological fate of chemicals.
2008 Jul; 36(7):1385-405. doi:
10.1124/dmd.108.020479. [PMID: 18426954] - Sang-Seon Yun, Weiming Li. Identification of squalamine in the plasma membrane of white blood cells in the sea lamprey, Petromyzon marinus.
Journal of lipid research.
2007 Dec; 48(12):2579-86. doi:
10.1194/jlr.m700294-jlr200. [PMID: 17726196] - Austin C Li, Andrew M Sabo, Timothy McCormick, Sean M Johnston. Quantitative analysis of squalamine, a self-ionization-suppressing aminosterol sulfate, in human plasma by LC-MS/MS.
Journal of pharmaceutical and biomedical analysis.
2004 Feb; 34(3):631-41. doi:
10.1016/s0731-7085(03)00556-9. [PMID: 15127819] - Desirée Hao, Lisa A Hammond, S Gail Eckhardt, Amita Patnaik, Chris H Takimoto, Garry H Schwartz, Andrew D Goetz, Anthony W Tolcher, Heather A McCreery, Khalid Mamun, Jon I Williams, Kenneth J Holroyd, Eric K Rowinsky. A Phase I and pharmacokinetic study of squalamine, an aminosterol angiogenesis inhibitor.
Clinical cancer research : an official journal of the American Association for Cancer Research.
2003 Jul; 9(7):2465-71. doi:
. [PMID: 12855619] - P Bhargava, J L Marshall, W Dahut, N Rizvi, N Trocky, J I Williams, H Hait, S Song, K J Holroyd, M J Hawkins. A phase I and pharmacokinetic study of squalamine, a novel antiangiogenic agent, in patients with advanced cancers.
Clinical cancer research : an official journal of the American Association for Cancer Research.
2001 Dec; 7(12):3912-9. doi:
. [PMID: 11751482] - P B Savage, C Li. Cholic acid derivatives: novel antimicrobials.
Expert opinion on investigational drugs.
2000 Feb; 9(2):263-72. doi:
10.1517/13543784.9.2.263. [PMID: 11060676] - B S Selinsky, Z Zhou, K G Fojtik, S R Jones, N R Dollahon, A E Shinnar. The aminosterol antibiotic squalamine permeabilizes large unilamellar phospholipid vesicles.
Biochimica et biophysica acta.
1998 Mar; 1370(2):218-34. doi:
10.1016/s0005-2736(97)00265-4. [PMID: 9545568] - K Kikuchi, E M Bernard, A Sadownik, S L Regen, D Armstrong. Antimicrobial activities of squalamine mimics.
Antimicrobial agents and chemotherapy.
1997 Jul; 41(7):1433-8. doi:
10.1128/aac.41.7.1433. [PMID: 9210661]
