Neoastilbin (BioDeep_00000269793)

Main id: BioDeep_00000000950

 

PANOMIX_OTCML-2023


代谢物信息卡片


(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-4-chromanone

化学式: C21H22O11 (450.1162)
中文名称: 新落新妇苷
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C(C(=O)3)(C(Oc(c4)c3c(cc(O)4)O)c(c2)cc(c(O)c2)O)OC(O1)C(O)C(O)C(O)C(C)1
InChI: InChI=1S/C21H22O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-26,28-29H,1H3/t7-,15-,17+,18+,19-,20+,21-/m0/s1

描述信息

Neoastilbin is a flavanone glycoside that is (-)-taxifolin substituted by a alpha-L-rhamnosyl moiety at position 3 via a glycosidic linkage. It is an alpha-L-rhamnoside, a member of 3-hydroxyflavanones, a tetrahydroxyflavanone, a monosaccharide derivative, a flavanone glycoside and a member of 4-hydroxyflavanones. It is functionally related to a (-)-taxifolin. It is an enantiomer of an astilbin.
Neoastilbin is a natural product found in Neolitsea sericea, Dimorphandra mollis, and other organisms with data available.
A flavanone glycoside that is (-)-taxifolin substituted by a alpha-L-rhamnosyl moiety at position 3 via a glycosidic linkage.
Neosmitilbin is?isolated from?Garcinia?mangostana.
Neosmitilbin is?isolated from?Garcinia?mangostana.

同义名列表

15 个代谢物同义名

(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3-dihydrochromen-4-one; (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-3,4-dihydro-2H-chromen-3-yl 6-deoxy-alpha-L-mannopyranoside; (2S,3S)-dihydroquercetin 3-O-alpha-L-rhamnoside; (2S,3S)-Taxifolin 3-rhamnoside; Neosmitilbin; Neoastilbin; (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl]oxy]-4-chromanone; (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chroman-4-one; (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-chroman-4-one; (2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychroman-4-one; CHEBI:27669; 29838-67-3; C09803; (2S,3S) -3,5,7,3,4-Pentahydroxyflavanone 3-rhamnoside; Neoastilbin



数据库引用编号

15 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)

11 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。

亚细胞结构定位 关联基因列表
Cytoplasm 6 AKR1B1, CYP2D6, CYP3A4, NLRP3, SLC22A5, XDH
Peripheral membrane protein 2 ACHE, GORASP1
Endoplasmic reticulum membrane 2 CYP2D6, CYP3A4
Nucleus 2 ACHE, NLRP3
cytosol 4 AKR1B1, NLRP3, SLC22A5, XDH
nucleoplasm 1 AKR1B1
Cell membrane 4 ACHE, OR2AG1, SLC22A5, TNF
Cytoplasmic side 1 GORASP1
Multi-pass membrane protein 3 OR2AG1, SLC22A5, SLC22A6
Golgi apparatus membrane 2 GORASP1, NLRP3
Synapse 1 ACHE
cell surface 2 ACHE, TNF
Golgi apparatus 2 ACHE, GORASP1
Golgi membrane 2 GORASP1, NLRP3
lysosomal membrane 1 GAA
neuromuscular junction 1 ACHE
neuronal cell body 1 TNF
Cytoplasm, cytosol 1 NLRP3
Lysosome 1 GAA
plasma membrane 7 ACHE, GAA, INSRR, OR2AG1, SLC22A5, SLC22A6, TNF
Membrane 9 ACHE, CYP2D6, CYP3A4, GAA, INSRR, NLRP3, OR2AG1, SLC22A5, SLC22A6
apical plasma membrane 1 SLC22A5
axon 1 INSRR
basolateral plasma membrane 1 SLC22A6
caveola 1 SLC22A6
extracellular exosome 4 AKR1B1, GAA, SLC22A5, SLC22A6
Lysosome membrane 1 GAA
endoplasmic reticulum 3 CYP2D6, NLRP3, SLC22A5
extracellular space 6 ACHE, AKR1B1, IL10, IL6, TNF, XDH
lysosomal lumen 1 GAA
perinuclear region of cytoplasm 1 ACHE
mitochondrion 3 AKR1B1, CYP2D6, NLRP3
protein-containing complex 1 SLC22A6
intracellular membrane-bounded organelle 3 CYP2D6, CYP3A4, GAA
Microsome membrane 2 CYP2D6, CYP3A4
Single-pass type I membrane protein 1 INSRR
Secreted 5 ACHE, GAA, IL10, IL6, NLRP3
extracellular region 6 ACHE, GAA, IL10, IL6, NLRP3, TNF
Single-pass membrane protein 1 CYP2D6
Extracellular side 1 ACHE
external side of plasma membrane 1 TNF
recycling endosome 1 TNF
Single-pass type II membrane protein 1 TNF
Apical cell membrane 1 SLC22A5
Membrane raft 1 TNF
cis-Golgi network 1 GORASP1
Peroxisome 1 XDH
basement membrane 1 ACHE
sarcoplasmic reticulum 1 XDH
Cytoplasm, cytoskeleton, microtubule organizing center 1 NLRP3
Inflammasome 1 NLRP3
interphase microtubule organizing center 1 NLRP3
NLRP3 inflammasome complex 1 NLRP3
receptor complex 1 INSRR
phagocytic cup 1 TNF
brush border membrane 1 SLC22A5
Basolateral cell membrane 1 SLC22A6
Lipid-anchor, GPI-anchor 1 ACHE
Endomembrane system 1 NLRP3
microtubule organizing center 1 NLRP3
tertiary granule membrane 1 GAA
side of membrane 1 ACHE
basal plasma membrane 2 SLC22A5, SLC22A6
endoplasmic reticulum lumen 1 IL6
azurophil granule membrane 1 GAA
Endoplasmic reticulum-Golgi intermediate compartment membrane 1 GORASP1
Golgi apparatus, cis-Golgi network membrane 1 GORASP1
synaptic cleft 1 ACHE
Basal cell membrane 2 SLC22A5, SLC22A6
ficolin-1-rich granule membrane 1 GAA
[Isoform 3]: Endoplasmic reticulum 1 SLC22A5
[Tumor necrosis factor, soluble form]: Secreted 1 TNF
interleukin-6 receptor complex 1 IL6
insulin receptor complex 1 INSRR
autolysosome lumen 1 GAA
[Isoform H]: Cell membrane 1 ACHE
[C-domain 2]: Secreted 1 TNF
[Tumor necrosis factor, membrane form]: Membrane 1 TNF
[C-domain 1]: Secreted 1 TNF


文献列表

  • Dan Zheng, Yi-Ting Ruan, Zhong-Ping Yin, Qing-Feng Zhang. A Comparison of Solubility, Stability, and Bioavailability between Astilbin and Neoastilbin Isolated from Smilax glabra Rhizoma. Molecules (Basel, Switzerland). 2020 Oct; 25(20):. doi: 10.3390/molecules25204728. [PMID: 33076319]
  • Zhao-Guang Zheng, Ting-Ting Duan, Bao He, Dan Tang, Xiao-Bin Jia, Ru-Shang Wang, Jia-Xiao Zhu, You-Hua Xu, Quan Zhu, Liang Feng. Macrophage biospecific extraction and HPLC-ESI-MSn analysis for screening immunological active components in Smilacis Glabrae Rhizoma. Journal of pharmaceutical and biomedical analysis. 2013 Apr; 77(?):44-8. doi: 10.1016/j.jpba.2013.01.003. [PMID: 23384550]
  • Mai Fujiwara, Nobuo Yagi, Mitsuo Miyazawa. Tyrosinase inhibitory constituents from the bark of Peltophorum dasyrachis (yellow batai). Natural product research. 2011 Sep; 25(16):1540-8. doi: 10.1080/14786410903313106. [PMID: 21391111]
  • Yong-Jiang Xu, Rica Capistrano, Liene Dhooghe, Kenn Foubert, Filip Lemière, Sheila Maregesi, Aliou Baldé, Sandra Apers, Luc Pieters. Herbal medicines and infectious diseases: characterization by LC-SPE-NMR of some medicinal plant extracts used against malaria. Planta medica. 2011 Jul; 77(11):1139-48. doi: 10.1055/s-0030-1270719. [PMID: 21328178]
  • Chao Wang, Liping Zhu, Jingzhi Yang, Chuangjun Li, Dongming Zhang. [Chemical constituents from Sarcandra glabra]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2010 Mar; 35(6):714-7. doi: 10.4268/cjcmm20100612. [PMID: 20545194]
  • Xiang Zhou, Qiang Xu, Jian-Xin Li, Ting Chen. Structural revision of two flavanonol glycosides from Smilax glabra. Planta medica. 2009 May; 75(6):654-5. doi: 10.1055/s-0029-1185360. [PMID: 19199231]
  • Xiao-Ya Shang, Shuai Li, Su-Juan Wang, Yong-Chun Yang, Jian-Gong Shi. [Dihydroflavonol glycosides and flavan-3-ols from Bauhinia aurea]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2007 May; 32(9):815-8. doi: . [PMID: 17639982]
  • Liang Chen, Ye Yin, Hongwei Yi, Qiang Xu, Ting Chen. Simultaneous quantification of five major bioactive flavonoids in Rhizoma smilacis glabrae by high-performance liquid chromatography. Journal of pharmaceutical and biomedical analysis. 2007 Apr; 43(5):1715-20. doi: 10.1016/j.jpba.2007.01.007. [PMID: 17291706]
  • Jiu-zhi Yuan, De-qiang Dou, Ying-jie Chen, Wei Li, Koike Kazuo, Nikaido Tamotsu, Xin-sheng Yao. [Studies on dihydroflavonol glycosides from rhizome of Smilax glabra]. Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica. 2004 Sep; 29(9):867-70. doi: . [PMID: 15575206]