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没食子酸辛酯

5篇引用文献 COA COA
    级别和纯度:
  • ≥98%
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货号 (SKU) 包装规格 是否现货 价格 数量
O137952-5g
 5g 现货 Stock Image
O137952-25g
 25g 现货 Stock Image
O137952-100g
 100g 现货 Stock Image
O137952-500g
 500g 现货 Stock Image
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Anti-infection (2804) Bacterial (5911) Glucose Metabolism (3713) HSV (103) Influenza Virus (253) Virus (3767) 羧酸 (2181) 羰基化合物 (2389)
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基本描述

别名 没食子酸正辛酯 | 3,4,5-三羟基苯甲酸辛酯
英文别名 DTXCID2020713 | octyl 3,4,5-trihydroxybenzoate;Octyl gallate | 4-10-00-02005 (Beilstein Handbook Reference) | Octyl gallate, European Pharmacopoeia (EP) Reference Standard | Oktylester kyseliny gallove [Czech] | n-Octylgallate | OCTIL GALLATE [MART.] | BE
规格或纯度 ≥98%
英文名称 Octyl gallate
应用 Octyl gallate was used in a study to investigate the self-assembly in two comb-shaped supramolecules systems consisting of octyl gallate, hydrogen bonded to the pyridine groups of polyisoprene-block-poly(vinylpyridine) diblock copolymers using synchrotron radiation.
运输条件 常规运输
产品介绍

Octyl gallate was used in a study to investigate the self-assembly in two comb-shaped supramolecules systems consisting of octyl gallate, hydrogen bonded to the pyridine groups of polyisoprene-block-poly(vinylpyridine) diblock copolymers using synchrotron radiation.

Octyl gallate was used in a study to investigate the self-assembly in two comb-shaped supramolecules systems consisting of octyl gallate, hydrogen bonded to the pyridine groups of polyisoprene-block-poly(vinylpyridine) diblock copolymers using synchrotron radiation.
纯度 ≥98%

关联靶点（人）

ESR1 Tclin Estrogen receptor alpha (17718 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
NR3C1 Tclin Glucocorticoid receptor (14987 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AR Tclin Androgen Receptor (11781 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AKR1B1 Tclin Aldose reductase (1404 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AKR1A1 Tchem Aldehyde reductase (91 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
NFKB1 Tclin Nuclear factor NF-kappa-B p105 subunit (1459 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
CCRF-CEM (65223 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
MCF7 (126967 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AKR1C3 Tchem Aldo-keto-reductase family 1 member C3 (1414 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AKR1C4 Tchem Aldo-keto reductase family 1 member C4 (224 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AKR1C2 Tchem Aldo-keto reductase family 1 member C2 (639 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AKR1C1 Tchem Aldo-keto reductase family 1 member C1 (475 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
AKR1B10 Tchem Aldo-keto reductase family 1 member B10 (300 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UGT1A1 Tchem UDP-glucuronosyltransferase 1-1 (448 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UGT1A6 Tbio UDP-glucuronosyltransferase 1-6 (221 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UGT1A7 Tbio UDP-glucuronosyltransferase 1-7 (106 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UGT1A9 Tbio UDP-glucuronosyltransferase 1-9 (343 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UGT1A10 Tbio UDP-glucuronosyltransferase 1-10 (257 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
UGT2A1 UDP-glucuronosyltransferase 2A1 (59 活性数据)
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关联靶点（其它种属）

ERG1 Squalene monooxygenase (20 活性数据)
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Nannizzia gypsea (2039 活性数据)
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Pseudomonas aeruginosa (123386 活性数据)
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Ralstonia solanacearum (520 活性数据)
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Proteus vulgaris (5823 活性数据)
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Micrococcus luteus (7463 活性数据)
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Staphylococcus aureus (210822 活性数据)
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Klebsiella aerogenes (4963 活性数据)
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Escherichia coli (133304 活性数据)
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Streptococcus mutans (2687 活性数据)
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Aspergillus flavus (8875 活性数据)
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Aspergillus niger (16508 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Bacillus subtilis (32866 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Saccharomyces cerevisiae (19171 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Corynebacterium ammoniagenes (75 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Cutibacterium acnes (887 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Zygosaccharomyces bailii (36 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Aspergillus fumigatus (16427 活性数据)
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Cryptococcus neoformans (21258 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Candida albicans (78123 活性数据)
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Candida tropicalis (8381 活性数据)
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Trichophyton rubrum (3646 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Human respirovirus 3 (1674 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Vaccinia virus (4609 活性数据)
活性类型 Relation Activity value Units Action Type 期刊 PubMed Id doi Assay Aladdin ID
Human immunodeficiency virus 1 (70413 活性数据)
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Reovirus sp. (323 活性数据)
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Sindbis virus (1599 活性数据)
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Vesicular stomatitis virus (4460 活性数据)
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Influenza A virus (11224 活性数据)
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Punta Toro virus (1491 活性数据)
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Human immunodeficiency virus 2 (5592 活性数据)
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Coxsackievirus B4 (2249 活性数据)
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Respiratory syncytial virus (3434 活性数据)
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Salmonella enterica (1497 活性数据)
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Epidermophyton floccosum (561 活性数据)
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L1210 (27553 活性数据)
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L929 (3802 活性数据)
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B16-F10 (4610 活性数据)
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Aspergillus parasiticus (296 活性数据)
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Coptotermes formosanus (677 活性数据)
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Felid alphaherpesvirus 1 (460 活性数据)
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Feline coronavirus (624 活性数据)
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Trichophyton mentagrophytes (4846 活性数据)
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Influenza A virus H3N2 (588 活性数据)
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作用机制

作用机制 Action Type target ID Target Name Target Type Target Organism Binding Site Name 参考文献

名称和识别符

PubChem SID 488183469
EC号 213-853-0
分子类型 小分子
IIUPAC Name octyl 3,4,5-trihydroxybenzoate
INCHI 1S/C15H22O5/c1-2-3-4-5-6-7-8-20-15(19)11-9-12(16)14(18)13(17)10-11/h9-10,16-18H,2-8H2,1H3
InChi Key NRPKURNSADTHLJ-UHFFFAOYSA-N
Smiles CCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
Isomeric SMILES CCCCCCCCOC(=O)C1=CC(=C(C(=C1)O)O)O
分子量 282.33
Beilstein号 2132305
Reaxy-Rn 2132305
Reaxys-RN link address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2132305&ln=

化学和物理性质

溶解性 souble in Methanol
熔点 100 °C
分子量 282.330 g/mol
XLogP3 3.700
氢键供体数Hydrogen Bond Donor Count 3
氢键受体数Hydrogen Bond Acceptor Count 5
可旋转键计数Rotatable Bond Count 9
精确质量Exact Mass 282.147 Da
单同位素质量Monoisotopic Mass 282.147 Da
拓扑极表面积Topological Polar Surface Area 87.000 Ų
重原子数Heavy Atom Count 20
形式电荷Formal Charge 0
复杂度Complexity 269.000
同位素原子数Isotope Atom Count 0
定义的原子立体中心计数Defined Atom Stereocenter Count 0
未定义的原子立体中心计数Undefined Atom Stereocenter Count 0
定义的键立体中心计数Defined Bond Stereocenter Count 0
未定义的键立体中心计数Undefined Bond Stereocenter Count 0
所有立体化学键的总数The total count of all stereochemical bonds 0
共价键合单元计数Covalently-Bonded Unit Count 1

安全和危险性（GHS）

象形图 GHS07
信号词 警告
危险声明

H302: 吞食有害

H317: 可能引起皮肤过敏反应
预防措施声明

P261: 避免吸入灰尘/烟雾/气体/雾/蒸汽/喷雾

P264: 处理后要彻底洗手。

P270: 使用本产品时，请勿进食、饮水或吸烟。

P272: 被污染的工作服不允许离开工作场所

P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。

P321: 特殊处理（请参阅此标签上的...）。

P330: 漱口

P302+P352: 如皮肤沾染：用水充分清洗。

P333+P313: 如发生皮肤刺激或皮疹：求医/就诊。

P362+P364: 脱掉沾污的衣服，清洗后方可重新使用。

P501: 将内容物/容器处理到。。。

P301+P317: 如果被吞咽：请寻求医疗帮助。
WGK Germany 1
RTECS LW8225000

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批号(Lot Number) 证书类型 货号
D2324190 分析证书 O137952
L2416384 分析证书 O137952
L2405591 分析证书 O137952
K2427193 分析证书 O137952
L2410090 分析证书 O137952
K2117124 分析证书 O137952
K2117081 分析证书 O137952
K2117126 分析证书 O137952
K2117132 分析证书 O137952
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引用文献

1. Isao Kubo,Ken-Ichi Fujita,Ken-Ichi Nihei.  (2002-10-31)  Anti-Salmonella activity of alkyl gallates..  Journal of agricultural and food chemistry,  50  ((23)): (6692-6696).  [PMID:12405763]
2. Matthew G Soars,Edward L Mattiuz,David A Jackson,Palaniappan Kulanthaivel,William J Ehlhardt,Steven A Wrighton.  (2003-03-12)  Biosynthesis of drug glucuronides for use as authentic standards..  Journal of pharmacological and toxicological methods,  47  ((3)): (161-168).  [PMID:12628307]
3. Isao Kubo,Ken-ichi Fujita,Ken-ichi Nihei,Atsuko Nihei.  (2004-03-05)  Antibacterial activity of akyl gallates against Bacillus subtilis..  Journal of agricultural and food chemistry,  52  ((5)): (1072-1076).  [PMID:14995100]
4. Gavin A E Wong,Neil H Shear.  (2004-03-05)  Melkersson-Rosenthal syndrome associated with allergic contact dermatitis from octyl and dodecyl gallates..  Contact dermatitis,  49  ((5)): (266-267).  [PMID:14996058]
5. Paul D Stapleton,Saroj Shah,James C Anderson,Yukihiko Hara,Jeremy M T Hamilton-Miller,Peter W Taylor.  (2004-05-04)  Modulation of beta-lactam resistance in Staphylococcus aureus by catechins and gallates..  International journal of antimicrobial agents,  23  ((5)): (462-467).  [PMID:15120724]
6. Liisa Törmäkangas,Pia Vuorela,Elise Saario,Maija Leinonen,Pekka Saikku,Heikki Vuorela.  (2005-09-06)  In vivo treatment of acute Chlamydia pneumoniae infection with the flavonoids quercetin and luteolin and an alkyl gallate, octyl gallate, in a mouse model..  Biochemical pharmacology,  70  ((8)): (1222-1230).  [PMID:16139801]
7. K Kreander,P Vuorela,P Tammela.  (2006-05-10)  A rapid screening method for detecting active compounds against erythromycin-resistant bacterial strains of Finnish origin..  Folia microbiologica,  50  ((6)): (487-493).  [PMID:16681145]
8. Misao Uozaki,Hisashi Yamasaki,Yukiko Katsuyama,Masanori Higuchi,Tomihiko Higuti,A Hajime Koyama.  (2006-09-05)  Antiviral effect of octyl gallate against DNA and RNA viruses..  Antiviral research,  73  ((2)): (85-91).  [PMID:16950523]
9. Hisashi Yamasaki,Misao Uozaki,Yukiko Katsuyama,Hirotoshi Utsunomiya,Tsutomu Arakawa,Masanori Higuchi,Tomihiko Higuti,A Hajime Koyama.  (2007-03-06)  Antiviral effect of octyl gallate against influenza and other RNA viruses..  International journal of molecular medicine,  19  ((4)): (685-688).  [PMID:17334645]
10. M L García-Melgares,J de la Cuadra,B Martín,C Laguna,L Martínez,V Alegre.  (2007-11-24)  [Sensitization to gallates: review of 46 cases]..  Actas dermo-sifiliograficas,  98  ((10)): (688-693).  [PMID:18035026]
11. E Sierra-Campos,M A Valdez-Solana,D Matuz-Mares,I Velázquez,J P Pardo.  (2009-02-10)  Induction of morphological changes in Ustilago maydis cells by octyl gallate..  Microbiology (Reading, England),  155  ((Pt 2)): (604-611).  [PMID:19202109]
12. Javier Rúa,Laura Fernández-Álvarez,Cristina de Castro,Pilar Del Valle,Dolores de Arriaga,María Rosario García-Armesto.  (2010-11-03)  Antibacterial activity against foodborne Staphylococcus aureus and antioxidant capacity of various pure phenolic compounds..  Foodborne pathogens and disease,  8  ((1)): (149-157).  [PMID:21034269]
13. Clarissa A S de Cordova,Claudriana Locatelli,Laura S Assunção,Bruno Mattei,Alessandra Mascarello,Evelyn Winter,Ricardo J Nunes,Rosendo A Yunes,Tânia B Creczynski-Pasa.  (2011-08-23)  Octyl and dodecyl gallates induce oxidative stress and apoptosis in a melanoma cell line..  Toxicology in vitro : an international journal published in association with BIBRA,  25  ((8)): (2025-2034).  [PMID:21856409]
14. Jun Liang,Richard D Ludescher.  (2011-11-09)  Antioxidants modulate molecular mobility, oxygen permeability, and microstructure in zein films..  Journal of agricultural and food chemistry,  59  ((24)): (13173-13180).  [PMID:22060618]
15. Nagao Totani,Sayuri Tateishi,Tatsuya Takimoto,Risa Shinohara,Hideaki Sasaki.  (2012-06-13)  Ferulic acid esters and weight-loss promoting effects in rats..  Journal of oleo science,  61  ((6)): (331-336).  [PMID:22687778]
16. Gabrielle Jacklin Eler,Israel Souza Santos,Amarilis Giaretta de Moraes,Márcio Shigueaki Mito,Jurandir Fernando Comar,Rosane Marina Peralta,Adelar Bracht.  (2013-09-10)  Kinetics of the transformation of n-propyl gallate and structural analogs in the perfused rat liver..  Toxicology and applied pharmacology,  273  ((1)): (35-46).  [PMID:24012771]
17. I Kubo,P Xiao,K Fujita.  (2001-02-24)  Antifungal activity of octyl gallate: structural criteria and mode of action..  Bioorganic & medicinal chemistry letters,  11  ((3)): (347-350).  [PMID:11212107]
18. Nurit Bar Nun,Dina Plakhine,Daniel M Joel,Alfred M Mayer.  (2003-08-30)  Changes in the activity of the alternative oxidase in Orobanche seeds during conditioning and their possible physiological function..  Phytochemistry,  64  ((1)): (235-241).  [PMID:12946422]
19. Eve-Marie Josse,Jean-Pierre Alcaraz,Anne-Marie Labouré,Marcel Kuntz.  (2003-09-03)  In vitro characterization of a plastid terminal oxidase (PTOX)..  European journal of biochemistry,  270  ((18)): (3787-3794).  [PMID:12950262]
20. Anna Radomska.  (2003-10-15)  Antioxidant properties of captopril in vitro..  Acta poloniae pharmaceutica,  60  ((3)): (191-195).  [PMID:14556487]
21. Tae Joung Ha,Ken-ichi Nihei,Isao Kubo.  (2004-05-13)  Lipoxygenase inhibitory activity of octyl gallate..  Journal of agricultural and food chemistry,  52  ((10)): (3177-3181).  [PMID:15137872]
22. Fu-Lan Hsu,Hui-Ting Chang,Shang-Tzen Chang.  (2006-06-06)  Evaluation of antifungal properties of octyl gallate and its synergy with cinnamaldehyde..  Bioresource technology,  98  ((4)): (734-738).  [PMID:16750625]
23. Tsutomu Arakawa,Yoshiko Kita,A Hajime Koyama.  (2008-02-05)  Solubility enhancement of gluten and organic compounds by arginine..  International journal of pharmaceutics,  355  ((1-2)): (220-223).  [PMID:18242019]
24. Hirofumi Shibata,Tatsuro Nakano,M Anowar Khasru Parvez,Yoshihiro Furukawa,Akio Tomoishi,Shingo Niimi,Naokatu Arakaki,Tomihiko Higuti.  (2009-02-19)  Triple combinations of lower and longer alkyl gallates and oxacillin improve antibiotic synergy against methicillin-resistant Staphylococcus aureus..  Antimicrobial agents and chemotherapy,  53  ((5)): (2218-2220).  [PMID:19223633]
25. Jiangxin Wang,Milton Sommerfeld,Qiang Hu.  (2009-05-02)  Occurrence and environmental stress responses of two plastid terminal oxidases in Haematococcus pluvialis (Chlorophyceae)..  Planta,  230  ((1)): (191-203).  [PMID:19408010]
26. Xiaojun Li,Liang Shang,Yaohua Wu,Suzanne Abbas,Dong Li,Patrick Netter,Mohamed Ouzzine,Hui Wang,Jacques Magdalou.  (2011-03-23)  Identification of the human UDP-glucuronosyltransferase isoforms involved in the glucuronidation of the phytochemical ferulic acid..  Drug metabolism and pharmacokinetics,  26  ((4)): (341-350).  [PMID:21422672]
27. Yuling Li, Xiaotong Wu, Zixuan Wu, Mingmin Zhong, Xiaoping Su, Youai Ye, Yan Liu, Lei Tan, Yong Liang.  (2022)  Colorimetric sensor array based on CoOOH nanoflakes for rapid discrimination of antioxidants in food.  Analytical Methods,  14  (28): (2754-2760).  [PMID:35781305] [10.1039/D2AY00692H]
28. Man-Tong Zhao, Zhong-Yuan Liu, Guan-Hua Zhao, De-Yang Li, Guang-Hua Xia, Fa-Wen Yin, Da-Yong Zhou.  (2022)  Investigation of the antioxidation capacity of gallic acid and its alkyl esters with different chain lengths for dried oyster during ambient storage.  INTERNATIONAL JOURNAL OF FOOD SCIENCE AND TECHNOLOGY,  57  (4): (2435-2446).  [10.1111/ijfs.15604]
29. Dong Cai, Xinmiao Wang, Qian Wang, Peiyong Tong, Weiyuan Niu, Xu Guo, Jinghan Yu, Xuan Chen, Xiaoyang Liu, Dayong Zhou, Fawen Yin.  (2024)  Controlled release characteristics of alkyl gallates and gallic acid from β-cyclodextrin inclusion complexes of alkyl gallates.  FOOD CHEMISTRY,  460  (140726).  [PMID:39111044] [10.1016/j.foodchem.2024.140726]
30. Yajie Luan, Huaqi Wang, Changfeng Han, Xiuying Zhao, Youping Wu.  (2024)  Effect of Gallic Acid and Its Ester Derivatives on Thermo-oxidative Aging Resistance of Natural Rubber.  ACS Applied Polymer Materials,  6  (16): (9752-9762).  [10.1021/acsapm.4c01606]
31. Xuan Chen, Xinmiao Wang, Qian Wang, Dong Cai, Jinghan Yu, Dayong Zhou, Xiaoyang Liu, Fawen Yin.  (2025)  Hydrolysis and transport characteristics of starch inclusion complexes with long-chain alkyl gallates: Controlled two-step release of gallic acid and retardation of starch digestion.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,  (139337).  [PMID:39755318] [10.1016/j.ijbiomac.2024.139337]

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