5-O-阿魏酰奎尼酸

5-O-Feruloylquinic acid

	产品编号	CFN92889
	CAS编号	40242-06-6
	分子式 = 分子量	C₁₇H₂₀O₉ = 368.3
	产品纯度	>=98%
	物理属性	Powder
	化合物类型	Phenylpropanoids
	植物来源	The fruits of Coffea canephorra var. Robusta
ChemFaces的产品在影响因子大于5的优秀和顶级科学期刊中被引用

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产品名称	产品编号	CAS编号	包装	QQ客服
5-O-阿魏酰奎尼酸	CFN92889	40242-06-6	1mg	QQ客服：1457312923
5-O-阿魏酰奎尼酸	CFN92889	40242-06-6	5mg	QQ客服：1457312923
5-O-阿魏酰奎尼酸	CFN92889	40242-06-6	10mg	QQ客服：1457312923
5-O-阿魏酰奎尼酸	CFN92889	40242-06-6	20mg	QQ客服：1457312923

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ChemFaces的产品在许多优秀和顶级科学期刊中被引用

Cell. 2018 Jan 11;172(1-2):249-261.e12.
doi: 10.1016/j.cell.2017.12.019.
IF=36.216(2019)

PMID: 29328914

Cell Metab. 2020 Mar 3;31(3):534-548.e5.
doi: 10.1016/j.cmet.2020.01.002.
IF=22.415(2019)

PMID: 32004475

Mol Cell. 2017 Nov 16;68(4):673-685.e6.
doi: 10.1016/j.molcel.2017.10.022.
IF=14.548(2019)

PMID: 29149595

ACS Nano. 2018 Apr 24;12(4): 3385-3396.
doi: 10.1021/acsnano.7b08969.
IF=13.903(2019)

PMID: 29553709

Nature Plants. 2016 Dec 22;3: 16206.
doi: 10.1038/nplants.2016.205.
IF=13.297(2019)

PMID: 28005066

Sci Adv. 2018 Oct 24;4(10): eaat6994.
doi: 10.1126/sciadv.aat6994.
IF=12.804(2019)

PMID: 30417089

Gyeongsang National University (Korea)

Lodz University of Technology (Poland)

University of Padjajaran (Indonesia)

Cancer Research Initatives Foundation(CARIF) (Malaysia)

Shanghai University of TCM (China)

Universiti Kebangsaan Malaysia (Malaysia)

Universite de Lille1 (France)

University of Otago (New Zealand)

Complutense University of Madrid (Spain)

Chulalongkorn University (Thailand)

University of Maryland (USA)

University of Parma (Italy)

Nanjing University of Chinese Medicine (China)

Max Rubner-Institut (MRI) (Germany)

More...

Description:

5-O-feruloylquinic acid is a potent Sirt1 agonist, it is a potential lead compound that can be further tested in drug development process for diseases associated with aging.

Targets:

Sirt1

In vitro:

Journal of Biomolecular Structure and Dynamics, 2013, 31(11):1207-1218.

Investigation of silent information regulator 1 (Sirt1) agonists from Traditional Chinese Medicine.[Pubmed: 23075283]

Silent information regulator 1 (Sirt1), a class III nicotinamide adenine dinucleotide dependent histone deacetylases, is important in cardioprotection, neuroprotection, metabolic disease, calorie restriction, and diseases associated with aging.
METHODS AND RESULTS:
Traditional Chinese Medicine (TCM) compounds from TCM Database@Taiwan ( http://tcm.cmu.edu.tw/ ) were employed for screening potent Sirt1 agonists, and molecular dynamics (MD) simulation was implemented to simulate ligand optimum docking poses and protein structure under dynamic conditions. TCM compounds such as (S)-tryptophan-betaxanthin, 5-O-feruloylquinic acid, and RosA exhibited good binding affinity across different computational methods, and their drug-like potential were validated by MD simulation. Docking poses indicate that the carboxylic group of the three candidates generated H-bonds with residues in the protein chain from Ser441 to Lys444 and formed H-bond, π-cation interactions, or hydrophobic contacts with Phe297 and key active residue, His363. During MD, stable π-cation interactions with residues Phe273 or Arg274 were formed by (S)-tryptophan-betaxanthin and RosA.
CONCLUSIONS:
All candidates were anchored to His363 by stable π- or H-bonds. Hence, we propose (S)-tryptophan-betaxanthin, 5-O-feruloylquinic acid, and RosA as potential lead compounds that can be further tested in drug development process for diseases associated with aging.

产品名称	产品编号	CAS编号	分子式 = 分子量	位单	联系QQ
绿原酸乙酯; Ethyl chlorogenate	CFN91565	425408-42-0	C₁₈H₂₂O₉ = 382.4	5mg	QQ客服：3257982914
3-O-阿魏酰奎尼酸; 3-O-Feruloylquinic acid	CFN92393	1899-29-2	C₁₇H₂₀O₉ = 368.3	5mg	QQ客服：3257982914
甲基 3-O-阿魏酰奎尼酸酯; Methyl 3-O-feruloylquinate	CFN92446	154418-15-2	C₁₈H₂₂O₉ = 382.4	5mg	QQ客服：215959384
Cyclohexanecarboxylic acid; Cyclohexanecarboxylic acid	CFN92529	327161-03-5	C₁₆H₁₈O₉ = 354.3	5mg	QQ客服：1457312923
4-O-对香豆酰基奎宁酸; 4-O-Coumaroylquinic acid	CFN95508	53539-37-0	C₁₆H₁₈O₈ = 338.1	5mg	QQ客服：215959384
隐绿原酸; Cryptochlorogenic acid	CFN99117	905-99-7	C₁₆H₁₈O₉ = 354.31	20mg	QQ客服：215959384
甲基 4-咖啡酰奎尼酸酯; Methyl 4-caffeoylquinate	CFN92528	123372-74-7	C₁₇H₂₀O₉ = 368.3	5mg	QQ客服：3257982914
4-O-阿魏酰奎尼酸; 4-O-Feruloylquinic acid	CFN92392	2613-86-7	C₁₇H₂₀O₉ = 368.3	10mg	QQ客服：2159513211
5-O-对香豆酰基奎宁酸; 5-O-Coumaroylquinic acid	CFN95507	32451-86-8	C₁₆H₁₈O₈ = 338.3	5mg	QQ客服：1413575084
新绿原酸; Neochlorogenic acid	CFN97472	906-33-2	C₁₆H₁₈O₉ = 354.3	20mg	QQ客服：2056216494

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	1 mg	5 mg	10 mg	20 mg	25 mg
1 mM	2.7152 mL	13.5759 mL	27.1518 mL	54.3036 mL	67.8794 mL
5 mM	0.543 mL	2.7152 mL	5.4304 mL	10.8607 mL	13.5759 mL
10 mM	0.2715 mL	1.3576 mL	2.7152 mL	5.4304 mL	6.7879 mL
50 mM	0.0543 mL	0.2715 mL	0.543 mL	1.0861 mL	1.3576 mL
100 mM	0.0272 mL	0.1358 mL	0.2715 mL	0.543 mL	0.6788 mL