2,4-Bis[(R)-1-(2-hydroxy-3,3,5,5-tetramethyl-4,6-dioxo-1-cyclohexenyl)-2-methylpropyl]-6-(2-methylpropanoyl)benzene-1,3,5-triol (BioDeep_00000845663)

   


代谢物信息卡片


2,4-Bis[(R)-1-(2-hydroxy-3,3,5,5-tetramethyl-4,6-dioxo-1-cyclohexenyl)-2-methylpropyl]-6-(2-methylpropanoyl)benzene-1,3,5-triol

化学式: C38H52O10 (668.3560292)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC(C)C(C1=C(C(=C(C(=C1O)C(=O)C(C)C)O)C(C2=C(C(C(=O)C(C2=O)(C)C)(C)C)O)C(C)C)O)C3=C(C(C(=O)C(C3=O)(C)C)(C)C)O
InChI: InChI=1S/C38H52O10/c1-15(2)18(22-29(43)35(7,8)33(47)36(9,10)30(22)44)20-26(40)21(28(42)24(27(20)41)25(39)17(5)6)19(16(3)4)23-31(45)37(11,12)34(48)38(13,14)32(23)46/h15-19,40-43,45H,1-14H3/t18-,19-/m1/s1

描述信息

同义名列表

1 个代谢物同义名

2,4-Bis[(R)-1-(2-hydroxy-3,3,5,5-tetramethyl-4,6-dioxo-1-cyclohexenyl)-2-methylpropyl]-6-(2-methylpropanoyl)benzene-1,3,5-triol



数据库引用编号

4 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome(0)

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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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BioCyc(0)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

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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

  • Rosario Nicoletti, Maria Michela Salvatore, Pasquale Ferranti, Anna Andolfi. Structures and Bioactive Properties of Myrtucommulones and Related Acylphloroglucinols from Myrtaceae. Molecules (Basel, Switzerland). 2018 Dec; 23(12):. doi: 10.3390/molecules23123370. [PMID: 30572614]
  • Marcus Hans, Maël Charpentier, Volker Huch, Johann Jauch, Torsten Bruhn, Gerhard Bringmann, Dietmar Quandt. Stereoisomeric Composition of Natural Myrtucommulone A. Journal of natural products. 2015 Oct; 78(10):2381-9. doi: 10.1021/acs.jnatprod.5b00358. [PMID: 26457652]
  • Cindy Grandjenette, Michael Schnekenburger, Franck Morceau, Fabienne Mack, Katja Wiechmann, Oliver Werz, Mario Dicato, Marc Diederich. Dual induction of mitochondrial apoptosis and senescence in chronic myelogenous leukemia by myrtucommulone A. Anti-cancer agents in medicinal chemistry. 2015; 15(3):363-73. doi: 10.2174/1871520614666141202143757. [PMID: 25469628]
  • Kathleen Gerbeth, Jan Hüsch, Jürgen Meins, Antonietta Rossi, Lidia Sautebin, Katja Wiechmann, Oliver Werz, Carsten Skarke, Jeffrey S Barrett, Manfred Schubert-Zsilavecz, Mona Abdel-Tawab. Myrtucommulone from Myrtus communis: metabolism, permeability, and systemic exposure in rats. Planta medica. 2012 Dec; 78(18):1932-8. doi: 10.1055/s-0032-1327881. [PMID: 23150076]
  • Filippo Cottiglia, Laura Casu, Marco Leonti, Pierluigi Caboni, Costantino Floris, Bernardetta Busonera, Pamela Farci, Aicha Ouhtit, Giuseppina Sanna. Cytotoxic phloroglucinols from the leaves of Myrtus communis. Journal of natural products. 2012 Feb; 75(2):225-9. doi: 10.1021/np2009219. [PMID: 22276775]
  • Christel Fiorini-Puybaret, Marie-Françoise Aries, Bernard Fabre, Stelianos Mamatas, Joëlle Luc, Arnaud Degouy, Marco Ambonati, Carine Mejean, Florence Poli. Pharmacological properties of Myrtacine® and its potential value in acne treatment. Planta medica. 2011 Sep; 77(14):1582-9. doi: 10.1055/s-0030-1270955. [PMID: 21452108]
  • Kathleen Gerbeth, Jürgen Meins, Oliver Werz, Manfred Schubert-Zsilavecz, Mona Abdel-Tawab. Determination of myrtucommulone from Myrtus communis in human and rat plasma by liquid chromatography/tandem mass spectrometry. Planta medica. 2011 Mar; 77(5):450-4. doi: 10.1055/s-0030-1250459. [PMID: 21049398]
  • Antonietta Rossi, Rosanna Di Paola, Emanuela Mazzon, Tiziana Genovese, Rocco Caminiti, Placido Bramanti, Carlo Pergola, Andreas Koeberle, Oliver Werz, Lidia Sautebin, Salvatore Cuzzocrea. Myrtucommulone from Myrtus communis exhibits potent anti-inflammatory effectiveness in vivo. The Journal of pharmacology and experimental therapeutics. 2009 Apr; 329(1):76-86. doi: 10.1124/jpet.108.143214. [PMID: 19056932]
  • Anthony R Carroll, Jasmine Lamb, Roger Moni, Gordon P Guymer, Paul I Forster, Ronald J Quinn. Myrtucommulones F-I, phloroglucinols with thyrotropin-releasing hormone receptor-2 binding affinity from the seeds of Corymbia scabrida. Journal of natural products. 2008 Sep; 71(9):1564-8. doi: 10.1021/np800247u. [PMID: 18771320]
  • Giovanni Appendino, Federica Bianchi, Alberto Minassi, Olov Sterner, Mauro Ballero, Simon Gibbons. Oligomeric acylphloroglucinols from myrtle (Myrtus communis). Journal of natural products. 2002 Mar; 65(3):334-8. doi: 10.1021/np010441b. [PMID: 11908974]