{34-hydroxy-40-[(3E)-2-hydroxy-5-methylideneocta-3,7-dien-2-yl]-13,25,27,30,35-pentamethyl-39-methylidene-13-[2-(sulfooxy)ethyl]-4,8,12,17,21,26,32,36,41,45,49-undecaoxaundecacyclo[25.22.0.0^{3,25}.0^{5,22}.0^{7,20}.0^{9,18}.0^{11,16}.0^{31,48}.0^{33,46}.0^{35,44}.0^{37,42}]nonatetracontan-14-yl}oxidanesulfonic acid (BioDeep_00001876325)

Marine Natural Products Volatile Flavor Compounds

代谢物信息卡片

{34-hydroxy-40-[(3E)-2-hydroxy-5-methylideneocta-3,7-dien-2-yl]-13,25,27,30,35-pentamethyl-39-methylidene-13-[2-(sulfooxy)ethyl]-4,8,12,17,21,26,32,36,41,45,49-undecaoxaundecacyclo[25.22.0.0^{3,25}.0^{5,22}.0^{7,20}.0^{9,18}.0^{11,16}.0^{31,48}.0^{33,46}.0^{35,44}.0^{37,42}]nonatetracontan-14-yl}oxidanesulfonic acid

化学式: C55H82O21S2 (1142.4789762)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1CCC2(C(CC3C(O2)(CCC4C(O3)CC5C(O4)CC6C(O5)CC7C(O6)CC(C(O7)(C)CCOS(=O)(=O)O)OS(=O)(=O)O)C)OC8C1OC9C(C8)OC1CC2C(CC(=C)C(O2)C(C)(C=CC(=C)CC=C)O)OC1(C9O)C)C
InChI: InChI=1S/C55H82O21S2/c1-10-11-28(2)12-15-51(5,57)50-30(4)20-39-38(71-50)26-46-55(9,74-39)49(56)48-42(70-46)24-41-47(72-48)29(3)13-16-53(7)44(69-41)27-43-54(8,76-53)17-14-31-32(68-43)21-34-33(65-31)22-35-36(66-34)23-40-37(67-35)25-45(75-78(61,62)63)52(6,73-40)18-19-64-77(58,59)60/h10,12,15,29,31-50,56-57H,1-2,4,11,13-14,16-27H2,3,5-9H3,(H,58,59,60)(H,61,62,63)/b15-12+

描述信息

D009676 - Noxae > D011042 - Poisons > D008978 - Mollusk Venoms
D009676 - Noxae > D011042 - Poisons > D008387 - Marine Toxins
D009676 - Noxae > D011042 - Poisons > D014688 - Venoms

同义名列表

2 个代谢物同义名

数据库引用编号

6 个数据库交叉引用编号

ChEBI: CHEBI:166595
PubChem: 13988278
CAS: 112514-54-2
KEGG: C16872
PubChem: 135626066
KNApSAcK: 166595

分类词条

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

Sara F Ferreiro, Natalia Vilariño, Cristina Carrera, M Carmen Louzao, Antonio G Cantalapiedra, Germán Santamarina, J Manuel Cifuentes, Andrés C Vieira, Luis M Botana. Subacute Cardiotoxicity of Yessotoxin: In Vitro and in Vivo Studies. Chemical research in toxicology. 2016 06; 29(6):981-90. doi: 10.1021/acs.chemrestox.6b00012. [PMID: 27104637]
Andrea Fernández-Araujo, Amparo Alfonso, Mercedes R Vieytes, Luis M Botana. Yessotoxin activates cell death pathways independent of Protein Kinase C in K-562 human leukemic cell line. Toxicology in vitro : an international journal published in association with BIBRA. 2015 Oct; 29(7):1545-54. doi: 10.1016/j.tiv.2015.05.013. [PMID: 26025416]
A Fernández-Araujo, A Tobío, A Alfonso, L M Botana. Role of AKAP 149-PKA-PDE4A complex in cell survival and cell differentiation processes. The international journal of biochemistry & cell biology. 2014 Aug; 53(?):89-101. doi: 10.1016/j.biocel.2014.04.028. [PMID: 24813785]
Carlotta Francesca Orsi, Bruna Colombari, Federica Callegari, Antonio M Todaro, Andrea Ardizzoni, Gian Paolo Rossini, Elisabetta Blasi, Samuele Peppoloni. Yessotoxin inhibits phagocytic activity of macrophages. Toxicon : official journal of the International Society on Toxinology. 2010 Feb; 55(2-3):265-73. doi: 10.1016/j.toxicon.2009.07.033. [PMID: 19647763]
A Tubaro, A Giangaspero, M Ardizzone, M R Soranzo, F Vita, T Yasumoto, J M Maucher, J S Ramsdell, S Sosa. Ultrastructural damage to heart tissue from repeated oral exposure to yessotoxin resolves in 3 months. Toxicon : official journal of the International Society on Toxinology. 2008 Jun; 51(7):1225-35. doi: 10.1016/j.toxicon.2008.02.011. [PMID: 18402996]
Giuseppe Ronzitti, Gian Paolo Rossini. Yessotoxin induces the accumulation of altered E-cadherin dimers that are not part of adhesive structures in intact cells. Toxicology. 2008 Feb; 244(2-3):145-56. doi: 10.1016/j.tox.2007.11.008. [PMID: 18155345]
Federica Callegari, Silvio Sosa, Sara Ferrari, Maria Rosa Soranzo, Silvia Pierotti, Takeshi Yasumoto, Aurelia Tubaro, Gian Paolo Rossini. Oral administration of yessotoxin stabilizes E-cadherin in mouse colon. Toxicology. 2006 Oct; 227(1-2):145-55. doi: 10.1016/j.tox.2006.07.023. [PMID: 16950554]
G Ronzitti, F Callegari, C Malaguti, G P Rossini. Selective disruption of the E-cadherin-catenin system by an algal toxin. British journal of cancer. 2004 Mar; 90(5):1100-7. doi: 10.1038/sj.bjc.6601640. [PMID: 14997213]
A Tubaro, S Sosa, M Carbonatto, G Altinier, F Vita, M Melato, M Satake, T Yasumoto. Oral and intraperitoneal acute toxicity studies of yessotoxin and homoyessotoxins in mice. Toxicon : official journal of the International Society on Toxinology. 2003 Jun; 41(7):783-92. doi: 10.1016/s0041-0101(03)00032-1. [PMID: 12782078]