山梨酸

36篇引用文献

级别和纯度:

CAS编号: 110-44-1
分子式: C₆H₈O₂
分子量: 112.13
Beilstein号: 1098547
EC号: 203-768-7
PubChem编号: 643460

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货号 (SKU)	包装规格	是否现货
S431432-GMP-1kg	1kg	期货
S431432-GMP-5kg	5kg	期货
S431432-GMP-25kg	25kg	期货

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Anti-infection (2804) Antibiotic (2632) Bacterial (5911) Fungal (1689) Receptor Tyrosine Kinase (2808) 代谢物 (8911)

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基本描述

英文别名	(2-butenylidene) acetic acid \| CHEBI:35962 \| E-sorbic acid \| SCHEMBL1647 \| trans-trans-2,4-Hexadienoic acid \| DTXSID3021277 \| trans,trans-2,4-Hexadienoic acid \| alpha-trans-gamma-trans-Sorbic acid \| s4983 \| SORBIC ACID [HSDB] \| trans,trans-SA \| (2E,4E)-2,
规格或纯度	GMP, PharmPure™, ChP, BP, 欧洲药典（Ph.Eur）, FCC, NF, 医药级, E 200
英文名称	Sorbic acid
储存温度	室温
运输条件	常规运输
产品介绍	Sorbic acid is commonly used as a preservative in pharmaceutical formulations and cosmetics. It is also used as additive for the preservation of food.

关联靶点（人）

NR3C1 Tclin Glucocorticoid receptor (14987 活性数据)

点击查看靶蛋白信息： NR3C1

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)

点击查看靶蛋白信息： AR

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

GMNN Tbio Geminin (128009 活性数据)

点击查看靶蛋白信息： GMNN

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

关联靶点（其它种属）

Hdac6 Histone deacetylase 6 (222 活性数据)

点击查看靶蛋白信息： Hdac6

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

HD1 Histone deacetylase (38 活性数据)

点击查看靶蛋白信息： HD1

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

Pseudomonas aeruginosa (123386 活性数据)

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活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

Staphylococcus aureus (210822 活性数据)

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活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

Staphylococcus epidermidis (22802 活性数据)

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活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

Escherichia coli (133304 活性数据)

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活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

Enterococcus hirae (484 活性数据)

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活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

Aspergillus niger (16508 活性数据)

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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)

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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)

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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)

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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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活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

Mus musculus (284745 活性数据)

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活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

GCN5 Histone acetyltransferase GCN5 (89 活性数据)

点击查看靶蛋白信息： GCN5

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

TGR Thioredoxin glutathione reductase (28579 活性数据)

点击查看靶蛋白信息： TGR

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

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

EC号	203-768-7
分子类型	小分子
IIUPAC Name	(2E,4E)-hexa-2,4-dienoic acid
INCHI	1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4+
InChi Key	WSWCOQWTEOXDQX-MQQKCMAXSA-N
Smiles	CC=CC=CC(=O)O
Isomeric SMILES	C/C=C/C=C/C(=O)O
分子量	112.13
Beilstein号	1098547
Reaxy-Rn	1741831
Reaxys-RN link address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1741831&ln=

化学和物理性质

溶解性	1.6g/L
密度	1.2g/cm3at 20°C
闪点(℃)	127°C
沸点	228℃
熔点	132-135°C
分子量	112.130 g/mol
XLogP3	1.300
氢键供体数Hydrogen Bond Donor Count	1
氢键受体数Hydrogen Bond Acceptor Count	2
可旋转键计数Rotatable Bond Count	2
精确质量Exact Mass	112.052 Da
单同位素质量Monoisotopic Mass	112.052 Da
拓扑极表面积Topological Polar Surface Area	37.300 Å²
重原子数Heavy Atom Count	8
形式电荷Formal Charge	0
复杂度Complexity	122.000
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	2
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	2
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	H315: 引起皮肤刺激 H319: 引起严重眼睛刺激 H335: 可能引起呼吸道刺激
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。 P271: 仅在室外或通风良好的地方使用。 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...）。 P302+P352: 如皮肤沾染：用水充分清洗。 P304+P340: 如误吸入：将人转移到空气新鲜处，保持呼吸舒适体位。 P305+P351+P338: 如进入眼睛：用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出，取出隐形眼镜。继续冲洗。 P362+P364: 脱掉沾污的衣服，清洗后方可重新使用。 P405: 密闭存放 P403+P233: 存放在通风良好的地方。保持容器密闭。 P501: 将内容物/容器处理到。。。 P264+P265: 处理后彻底洗手[和…]。不要触摸眼睛。 P337+P317: 如果眼睛刺激持续：寻求医疗帮助。 P332+P317: 如果出现皮肤刺激：请寻求医疗帮助。 P319: 如果你感到不适，请寻求医疗帮助。
WGK Germany	1
RTECS	WG2100000
个人防护装备	dust mask type N95 (US),Eyeshields,Gloves

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引用文献

1. Gongduan Fan, Yujian Li, Banghao Du, Lei Yao, Chenjian Cai, Hao Li, Shoubin Chen, Jianyong Zou, Zhanglin Hong, Kai-Qin Xu. (2023) Peracetic acid combined with ultraviolet for ibuprofen degradation: Activation mechanism and reactive species contribution. PROCESS SAFETY AND ENVIRONMENTAL PROTECTION, 179 (157). [10.1016/j.psep.2023.09.012]
2. Ruiya Zhou, Juan Liu, Chi Zhou, Xu Zhang. (2023) Phototransformation of Lignin-related Compounds in Chromophoric Dissolved Organic Matter Solutions. WATER RESEARCH, 245 (120586). [PMID:37717330] [10.1016/j.watres.2023.120586]
3. Zhiyong Zheng, Yuehua Deng, Weining Xie, Sirui Chen, Xiaoxiao Liang, Shiyuan Liu, Yanbin Jiang, Huaiyu Yang. (2023) Co-Former Screening Method for Multicomponent Crystals Based on Partial Least Squares Regression: A Case Study of Ciprofloxacin. CRYSTAL GROWTH & DESIGN, 23 (5): (3244–3257). [10.1021/acs.cgd.2c01414]
4. Congcong He, Zhiming Yin, Jun He, Jungang Lv, Chengjun Wang. (2022) Occurrence and photodegradation of typical steroid hormones in surface water of urban lakes in Wuhan, China. Journal of Environmental Chemical Engineering, 10 (108602). [10.1016/j.jece.2022.108602]
5. Hengfeng Zhang, Yucong Zheng, Xiaochang C. Wang, Qionghua Zhang, Mawuli Dzakpasu. (2022) Photochemical behavior of constructed wetlands-derived dissolved organic matter and its effects on Bisphenol A photodegradation in secondary treated wastewater. SCIENCE OF THE TOTAL ENVIRONMENT, 845 (157300). [PMID:35842169] [10.1016/j.scitotenv.2022.157300]
6. Hui Yan, Wenhui Fan, Xu Chen, Hanqi Wang, Chong Qin, Xiaoqiang Jiang. (2022) Component spectra extraction and quantitative analysis for preservative mixtures by combining terahertz spectroscopy and machine learning. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 271 (120908). [PMID:35077979] [10.1016/j.saa.2022.120908]
7. Jiabin Chen, Jie Xu, Tongcai Liu, Qi Wang, Nan Li, Yalei Zhang, Libin Yang, Xuefei Zhou. (2022) Oxidation of tetracycline antibiotics by peracetic acid: Reaction kinetics, mechanism, and antibacterial activity change. CHEMICAL ENGINEERING JOURNAL, 431 (134190). [10.1016/j.cej.2021.134190]
8. Minghui Hong, Xuerui Yang, Xuewei Zhang, Yuefei Ji, Lei Zhou, Guangli Xiu, Zhigang Ni, Claire Richard. (2021) Aqueous photodegradation of the benzophenone fungicide metrafenone: Carbon-bromine bond cleavage mechanism. WATER RESEARCH, 206 (117775). [PMID:34706320] [10.1016/j.watres.2021.117775]
9. Binbin Zhang, Qi Zhou, Xinwei Zhang, Jiao Ma, Xin Cong, Qin Wang, Yonggui Liao, Yajiang Yang, Hong Wang. (2022) Thermostable fluorescent supramolecular gels constructed from a single gelator and its application in discriminating organic acids. JOURNAL OF MOLECULAR LIQUIDS, 346 (117137). [10.1016/j.molliq.2021.117137]
10. Chen Junzhe, Du Haiying, Xu Yifeng, Ma Boyu, Zheng Zhihong, Li Pengchan, Jiang Yuqiu. (2021) A turn-on fluorescent sensor based on coffee-ground carbon dots for the detection of sodium cyclamate. JOURNAL OF MATERIALS SCIENCE-MATERIALS IN ELECTRONICS, 32 (10): (13581-13587). [10.1007/s10854-021-05933-3]
11. Weibin Ma, Eric T. Johnson. (2021) Natural flavour (E,E)-2,4-heptadienal as a potential fumigant for control of Aspergillus flavus in stored peanut seeds: Finding new antifungal agents based on preservative sorbic acid. FOOD CONTROL, 124 (107938). [10.1016/j.foodcont.2021.107938]
12. Xiangrui Meng, Yuanyuan Sun, Lan Wang, Yuhao Li, Ruizhuo Ouyang, Ping Yuan, Yuqing Miao. (2021) Slow release of oxygen from carbamide peroxide for promoting the proliferation of human brain microvascular endothelial cells under hypoxia. Annals of Translational Medicine, 9 (2): (157). [PMID:33569459] [10.21037/atm-20-8137]
13. Wan-Jun Long, Hai-Long Wu, Tong Wang, Ming-Yue Dong, Ru-Qin Yu. (2021) Interference-free analysis of multi-class preservatives in cosmetic products using alternating trilinear decomposition modeling of liquid chromatography diode array detection data. MICROCHEMICAL JOURNAL, 162 (105847). [10.1016/j.microc.2020.105847]
14. Feng Jun, Li Jinxia, Huang Wenyi, Cheng Hao, Zhang Zhiyong, Li Lijun. (2021) Capillary Zone Electrophoresis Determination of Five Trace Food Additives in Beverage Samples Using Counterflow Transient Isotachophoresis. Food Analytical Methods, 14 (2): (380-388). [10.1007/s12161-020-01894-1]
15. Zhang Bei, Wu Di, Zhu Huaxiang, Fang Jing, Zhou Lina, Hou Baohong, Chen Wei. (2020) Solubility Measurements and Thermodynamic Properties of Sorbic Acid in Binary Solvent Mixtures of (Ethanol, 1-Propanol or 2-Propanol + Water) from 283.15 to 323.15 K. JOURNAL OF SOLUTION CHEMISTRY, 49 (7): (1068-1081). [10.1007/s10953-020-01011-0]
16. Shijie Sun, Hongyu Deng, Jinfeng Yang, Dongxu Zhou, Xing Wan, Fengxia Han. (2020) Photodegradation of Butyl 4-Hydroxybenzoate in the Presence of Peroxides and Mediated by Dissolved Organic Matter. ENVIRONMENTAL ENGINEERING SCIENCE, 37 (7): (497-508). [10.1089/ees.2019.0481]
17. Yang Li, Jing Wang, Sisi Fan, Fanan Wang, Zheng Shen, Hongmin Duan, Jinming Xu, Yanqiang Huang. (2021) Nitrogen-doped hierarchically porous carbon spheres for low concentration CO2 capture. Journal of Energy Chemistry, 53 (168). [10.1016/j.jechem.2020.05.019]
18. Hansun Fang, Zhiyou Ling, Fangling Guan, Wei Liao, Faying Lai, Ximei Liang. (2020) Photophysical and photochemical insights into the photodegradation of tricyclazole and pymetrozine in water bodies of a rice field. Environmental Chemistry, 17 (6): (436-444). [10.1071/EN19243]
19. Qian Wang, Jiayi Wang, Wu Ding, Dequan Zhang, Kevin Reed, Boce Zhang. (2018) Alternatives to carcinogenic preservatives in Chinese Sausage - Sorbic acid-loaded chitosan/tripolyphosphate nanoparticles. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 120 (28). [PMID:30098368] [10.1016/j.ijbiomac.2018.08.034]
20. Wei Liu, Lide Jin, Kai Chen, Yanyan Li, Randy A. Dahlgren, Meiping Ma, Xuedong Wang. (2018) Inhibitory effects of natural organic matter on methyltriclosan photolysis kinetics. RSC Advances, 8 (38): (21265-21271). [PMID:35539952] [10.1039/C8RA03512A]
21. Jing Fang, Meijing Zhang, Peipei Zhu, Jinbo Ouyang, Junbo Gong, Wei Chen, Fengxia Xu. (2015) Solubility and solution thermodynamics of sorbic acid in eight pure organic solvents. JOURNAL OF CHEMICAL THERMODYNAMICS, 85 (202). [10.1016/j.jct.2015.02.004]
22. Wei Yin, Huihui Chai, Renhua Liu, Changhu Chu, John A. Palasota, Xiaohui Cai. (2015) Click N-benzyl iminodiacetic acid: Novel silica-based tridentate zwitterionic stationary phase for hydrophilic interaction liquid chromatography. TALANTA, 132 (137). [PMID:25476290] [10.1016/j.talanta.2014.08.077]
23. Bingbing Sun, Li Qi, Minglin Wang. (2014) Determination of preservatives in soft drinks by capillary electrophoresis with ionic liquids as the electrolyte additives. JOURNAL OF SEPARATION SCIENCE, 37 (16): (2248-2252). [PMID:24910409] [10.1002/jssc.201400444]
24. Hongyue Guo, Renhua Liu, Jinjin Yang, Bingcheng Yang, Xinmiao Liang, Changhu Chu. (2012) A novel click lysine zwitterionic stationary phase for hydrophilic interaction liquid chromatography. JOURNAL OF CHROMATOGRAPHY A, 1223 (47). [PMID:22226552] [10.1016/j.chroma.2011.12.033]
25. Yuqi Yang, Weibin Ma, Eric T. Johnson, Yanli Xie, Renyong Zhao. (2025) Antifungal effects of three natural branched medium-chain fatty acids and their potential as fumigants against Aspergillus flavus in stored peanut seeds. FOOD CONTROL, 168 (110950). [10.1016/j.foodcont.2024.110950]
26. Xuewei Zhang, Jing Ye, Zhigang Ni, Xuerui Yang, Yuefei Ji, Jean-Marc Chovelon, Guangli Xiu, Lei Zhou. (2024) Aquatic photolysis of strobilurin fungicide kresoxim-methyl: kinetics, pathways, and effects of adjuvants. NEW JOURNAL OF CHEMISTRY, 48 (5): (2290-2298). [10.1039/D3NJ05471C]
27. Ruiya Zhou, Xu Zhang. (2024) Effects of Tryptophan and Tyrosine on the Transformation of Monophenols in Chromophoric Dissolved Organic Matter Solutions: Enhance the Forward Transformation and Reduce the Reverse Transformation. ENVIRONMENTAL SCIENCE & TECHNOLOGY, 58 (23): (10108-10115). [PMID:38813774] [10.1021/acs.est.4c02518]
28. Mingya Yao, Shuofeng Zhang, Meng Xie, Lingxi Zhao, Ru-Song Zhao. (2024) Efficient activation of peracetic acid by cobalt modified nitrogen-doped carbon nanotubes for drugs degradation: Performance and mechanism insight. CHEMOSPHERE, 358 (142277). [PMID:38719118] [10.1016/j.chemosphere.2024.142277]
29. Xiaoxiao Liang, Shiyuan Liu, Zebin Li, Yuehua Deng, Yanbin Jiang, Huaiyu Yang. (2024) Efficient cocrystal coformer screening based on a Machine learning Strategy: A case study for the preparation of imatinib cocrystal with enhanced physicochemical properties. EUROPEAN JOURNAL OF PHARMACEUTICS AND BIOPHARMACEUTICS, 196 (114201). [PMID:38309538] [10.1016/j.ejpb.2024.114201]
30. Hang Shen, Jianfu Chen, Kok Bing Tan. (2024) Ethyl cellulose matrixed poly(sulfur-co-sorbic acid) composite films: Regulation of properties and application for food preservation. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 279 (135183). [PMID:39214227] [10.1016/j.ijbiomac.2024.135183]
31. Chao Lei, Shun Zhang, Wen-Xin Liu, Ming-Li Ye, Yong-Gang Zhao. (2024) Fast Determination of Eleven Food Additives in River Water Using C18 Functionalized Magnetic Organic Polymer Nanocomposite Followed by High-Performance Liquid Chromatography. MOLECULES, 29 (15): (3675). [PMID:39125079] [10.3390/molecules29153675]
32. Yongxian Niu, Xi zhang, Wenbing Yu, Han Yin, Rui Lu, Zhenggang Liu, Fang Lu. (2024) Hydrogen bond regulation to promote the direct production of diosgenin from Dioscorea zingiberensis rhizomes. CHEMICAL ENGINEERING JOURNAL, 496 (153903). [10.1016/j.cej.2024.153903]
33. Miaomiao Dai, Xiaona Dong, Yongbo Yang, Yuwei Wu, Lulu Chen, Canlan Jiang, Zechong Guo, Tongyi Yang. (2024) Mechanistic insight into the impact of interaction between goethite and humic acid on the photooxidation and photoreduction of bifenthrin. ENVIRONMENTAL RESEARCH, (118779). [PMID:38552825] [10.1016/j.envres.2024.118779]
34. Xueyi Zhang, Wenshuang Sun, Yue Wang, Zhen Li, Xianqiang Huang, Tielong Li, Haitao Wang. (2024) Mechanochemical synthesis of microscale zero-valent iron/N-doped graphene-like biochar composite for degradation of tetracycline via molecular O2 activation. JOURNAL OF COLLOID AND INTERFACE SCIENCE, 659 (1015). [PMID:38241973] [10.1016/j.jcis.2024.01.061]
35. Yandong Yang, Xiangkun Jiang, Yi Yang, Jia Wang, Yahui Zhao, Shanshan Lin, Jiao Qu, Christopher J. Martyniuk, Yuanhui Zhao, Chao Li. (2024) Photochemical transformation of liquid crystal monomers in simulated environmental media: Kinetics, mechanism, toxicity variation and QSAR modeling. WATER RESEARCH, 261 (122062). [PMID:39002419] [10.1016/j.watres.2024.122062]
36. Hang Shen, Xiaojie Chen, Botuo Zheng, Huagui Zhang. (2024) Sorbic Acid–Tung Oil–Sulfur Terpolymer Prepared via Inverse Vulcanization and Its Application as Antibacterial and Toughness Modifier for Polylactide. ACS Applied Polymer Materials, 6 (23): (14351-14364). [10.1021/acsapm.4c02256]

溶液计算器

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计算溶液所需的质量、体积或浓度。

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稀释计算器

计算配制储备溶液所需的稀释度。

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复溶计算器

复溶计算器允许您快速计算试剂的体积，以复溶小瓶。只需输入试剂的质量和目标浓度，计算器将确定其余部分。

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