(2R,3aR,7S)-7-hydroxy-2,5,7-trimethyl-3a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[3,7a-dihydro-2H-indene-6,1-cyclopropane]-1-one (BioDeep_00001870898)

Main id: BioDeep_00000004037

 


代谢物信息卡片


(2R,3aR,7S)-7-hydroxy-2,5,7-trimethyl-3a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[3,7a-dihydro-2H-indene-6,1-cyclopropane]-1-one

化学式: C20H30O8 (398.194058)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1CC2(C=C(C3(CC3)C(C2C1=O)(C)O)C)OC4C(C(C(C(O4)CO)O)O)O
InChI: InChI=1S/C20H30O8/c1-9-6-20(28-17-15(25)14(24)13(23)11(8-21)27-17)7-10(2)19(4-5-19)18(3,26)16(20)12(9)22/h7,9,11,13-17,21,23-26H,4-6,8H2,1-3H3/t9-,11-,13-,14+,15-,16?,17+,18+,20-/m1/s1

描述信息

同义名列表

1 个代谢物同义名

(2R,3aR,7S)-7-hydroxy-2,5,7-trimethyl-3a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyspiro[3,7a-dihydro-2H-indene-6,1-cyclopropane]-1-one



数据库引用编号

6 个数据库交叉引用编号

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)

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

  • Paulo César Dos Reis Aranha, Lars Holm Rasmussen, Godelind Alma Wolf-Jäckel, Henrik Michael Elvang Jensen, Hans Christian Bruun Hansen, Christian Friis. Fate of ptaquiloside-A bracken fern toxin-In cattle. PloS one. 2019; 14(6):e0218628. doi: 10.1371/journal.pone.0218628. [PMID: 31226154]
  • Sarvesh K Rai, Rinku Sharma, Alka Kumari, Lars H Rasmussen, Rajendra D Patil, Rasbehari Bhar. Survey of ferns and clinico-pathological studies on the field cases of Enzootic bovine haematuria in Himachal Pradesh, a north-western Himalayan state of India. Toxicon : official journal of the International Society on Toxinology. 2017 Nov; 138(?):31-36. doi: 10.1016/j.toxicon.2017.08.010. [PMID: 28803058]
  • Arata Hidano, Basant Sharma, Karma Rinzin, Narapati Dahal, Kinzang Dukpa, Mark A Stevenson. Revisiting an old disease? Risk factors for bovine enzootic haematuria in the Kingdom of Bhutan. Preventive veterinary medicine. 2017 May; 140(?):10-18. doi: 10.1016/j.prevetmed.2017.02.011. [PMID: 28460742]
  • Paulo César Reis Aranha, Hans Christian Bruun Hansen, Lars Holm Rasmussen, Bjarne W Strobel, Christian Friis. Determination of ptaquiloside and pterosin B derived from bracken (Pteridium aquilinum) in cattle plasma, urine and milk. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences. 2014 Mar; 951-952(?):44-51. doi: 10.1016/j.jchromb.2014.01.022. [PMID: 24508676]
  • Rinku Sharma, Tej K Bhat, Om P Sharma. The environmental and human effects of ptaquiloside-induced enzootic bovine hematuria: a tumorous disease of cattle. Reviews of environmental contamination and toxicology. 2013; 224(?):53-95. doi: 10.1007/978-1-4614-5882-1_3. [PMID: 23232919]
  • Rui M Gil da Costa, Paula A Oliveira, Manuel Vilanova, Margarida M S M Bastos, Célia C Lopes, Carlos Lopes. Ptaquiloside-induced, B-cell lymphoproliferative and early-stage urothelial lesions in mice. Toxicon : official journal of the International Society on Toxinology. 2011 Nov; 58(6-7):543-9. doi: 10.1016/j.toxicon.2011.08.016. [PMID: 21907228]
  • S Gounalan, R Somvanshi, M Kataria, G S Bisht, B L Smith, D R Lauren. Effect of bracken (Pteridium a quilinum) and dryopteris (Dryopteris juxtaposita) fern toxicity in laboratory rabbits. Indian journal of experimental biology. 1999 Oct; 37(10):980-5. doi: NULL. [PMID: 10783757]
  • M Shahin, M R Moore, S Worrall, B L Smith, A A Seawright, A S Prakash. H-ras activation is an early event in the ptaquiloside-induced carcinogenesis: comparison of acute and chronic toxicity in rats. Biochemical and biophysical research communications. 1998 Sep; 250(2):491-7. doi: 10.1006/bbrc.1998.9341. [PMID: 9753659]
  • A J Ngomuo, R S Jones. Cytotoxicity studies of quercetin, shikimate, cyclohexanecarboxylate and ptaquiloside. Veterinary and human toxicology. 1996 Feb; 38(1):14-8. doi: NULL. [PMID: 8825742]
  • M Yoshida, T Saito. Non-urotoxic induction of hemorrhagic cystitis by braxin C, a bracken toxin, in guinea pigs. The Journal of toxicological sciences. 1994 May; 19(2):55-9. doi: 10.2131/jts.19.2_55. [PMID: 8072040]
  • M Asano, C Ohkubo, A Sasaki, I Hirono, K Yamada, H Niwa, M Ojika. Acute microcirculatory changes induced by intravenous administration to rabbits of ptaquiloside, a bracken carcinogen. Journal of ethnopharmacology. 1989 Nov; 27(1-2):213-20. doi: 10.1016/0378-8741(89)90092-5. [PMID: 2615421]