Vanicoside B (BioDeep_00000250296)

   

PANOMIX_OTCML-2023


代谢物信息卡片


[(2R,3R,4S,5R)-3-hydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-5-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxyoxolan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

化学式: C49H48O20 (956.2738807999999)
中文名称:
谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 53.33%

分子结构信息

SMILES: COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)COC(=O)C=CC4=CC=C(C=C4)O)O)OC(=O)C=CC5=CC=C(C=C5)O)COC(=O)C=CC6=CC=C(C=C6)O)O)O)O)O
InChI: InChI=1S/C49H48O20/c1-62-36-24-31(8-19-35(36)53)12-22-40(55)63-25-37-43(58)45(60)46(61)48(66-37)69-49(27-65-41(56)21-10-29-4-15-33(51)16-5-29)47(67-42(57)23-11-30-6-17-34(52)18-7-30)44(59)38(68-49)26-64-39(54)20-9-28-2-13-32(50)14-3-28/h2-24,37-38,43-48,50-53,58-61H,25-27H2,1H3/b20-9+,21-10+,22-12+,23-11+/t37-,38-,43-,44-,45+,46-,47+,48-,49-/m1/s1

描述信息

[(2R,3R,4S,5R)-3-hydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-5-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxyoxolan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate is a natural product found in Persicaria pensylvanica, Persicaria perfoliata, and Persicaria bungeana with data available.

同义名列表

4 个代谢物同义名

[(2R,3R,4S,5R)-3-hydroxy-4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-5-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxyoxolan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate; alpha-D-Glucopyranoside, 1,3,6-tris-O-(3-(4-hydroxyphenyl)-1-oxo-2-propenyl)-beta-D-fructofuranosyl, 6-(3-(4-hydroxy-3-methoxyphenyl)-2-propenoate), (1(1(E),3(E),6(E)),6(E))-; alpha-D-Glucopyranoside, 1,3,6-tris-O-((2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl)-beta-D-fructofuranosyl, 6-((2E)-3-(4-hydroxy-3-methoxypehnyl)-2-propenoate); Vanicoside B



数据库引用编号

8 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

  • Ping Xu, Xiang Wang, Tingting Lin, Qingsong Shao, Jianyun Peng, Chu Chu, Shengqiang Tong. A Strategy for Pinpointing Natural Bioactive Components Using Two-Dimensional Bioassay Profilings Combined with Comprehensive Two-Dimensional Countercurrent Chromatography × High-Performance Liquid Chromatography. Analytical chemistry. 2022 09; 94(37):12715-12722. doi: 10.1021/acs.analchem.2c02196. [PMID: 36076186]
  • Izabela Nawrot-Hadzik, Anna Choromańska, Renata Abel, Robert Preissner, Jolanta Saczko, Adam Matkowski, Jakub Hadzik. Cytotoxic Effect of Vanicosides A and B from Reynoutria sachalinensis Against Melanotic and Amelanotic Melanoma Cell Lines and in silico Evaluation for Inhibition of BRAFV600E and MEK1. International journal of molecular sciences. 2020 Jun; 21(13):. doi: 10.3390/ijms21134611. [PMID: 32610527]
  • Hong Xiao, Ranga Rao Ravu, Babu L Tekwani, Wei Li, Wen-Bin Liu, Melissa R Jacob, Shabana I Khan, Xiong Cai, Cai-Yun Peng, Ikhlas A Khan, Xing-Cong Li, Wei Wang. Biological evaluation of phytoconstituents from Polygonum hydropiper. Natural product research. 2017 Sep; 31(17):2053-2057. doi: 10.1080/14786419.2016.1269094. [PMID: 28000515]
  • Y Kawai, H Kumagai, H Kurihara, K Yamazaki, R Sawano, N Inoue. beta-Glucosidase inhibitory activities of phenylpropanoid glycosides, vanicoside A and B from Polygonum sachalinense rhizome. Fitoterapia. 2006 Sep; 77(6):456-9. doi: 10.1016/j.fitote.2006.05.008. [PMID: 16828242]
  • Hironori Kumagai, Yuji Kawai, Ryo Sawano, Hideyuki Kurihara, Koji Yamazaki, Norio Inoue. Antimicrobial substances from rhizomes of the giant knotweed Polygonum sachalinense against the fish pathogen Photobacterium damselae subsp. piscicida. Zeitschrift fur Naturforschung. C, Journal of biosciences. 2005 Jan; 60(1-2):39-44. doi: 10.1515/znc-2005-1-208. [PMID: 15787242]
  • M Takasaki, S Kuroki, M Kozuka, T Konoshima. New phenylpropanoid esters of sucrose from Polygonum lapathifolium. Journal of natural products. 2001 Oct; 64(10):1305-8. doi: 10.1021/np010222q. [PMID: 11678656]
  • X Sun, M L Zimmermann, J M Campagne, A T Sneden. New sucrose phenylpropanoid esters from Polygonum perfoliatum. Journal of natural products. 2000 Aug; 63(8):1094-7. doi: 10.1021/np000055e. [PMID: 10978204]
  • M L Zimmermann, A T Sneden. Vanicosides A and B, protein kinase C inhibitors from Polygonum pensylvanicum. Journal of natural products. 1994 Feb; 57(2):236-42. doi: 10.1021/np50104a007. [PMID: 8176400]