BioReagent, ≥99%(HPLC), synthetic BioReagent for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 24 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Sonrisas canónicas | C1C(N=C(S1)C2=NC3=C(S2)C=C(C=C3)O)C(=O)O |
|---|---|
| IUPAC Name | (4S)-2-(6-hydroxy-1,3-benzothiazol-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid |
| InChIKey | BJGNCJDXODQBOB-SSDOTTSWSA-N |
| INCHI | 1S/C11H8N2O3S2/c14-5-1-2-6-8(3-5)18-10(12-6)9-13-7(4-17-9)11(15)16/h1-3,7,14H,4H2,(H,15,16)/t7-/m1/s1 |
| Isómeros SMILES | C1[C@@H](N=C(S1)C2=NC3=C(S2)C=C(C=C3)O)C(=O)O |
| WGK Alemania | 3 |
| Peso molecular | 280.32 |
| Beilstein | 27(4)8934 |
| Reaxy-Rn | 269810 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=269810&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Clase | Carboxylic acids and derivatives |
| Subclass | Amino acids, peptides, and analogues |
| Intermediate Tree Nodes | Amino acids and derivatives |
| Direct Parent | Alpha amino acids and derivatives |
| Alternative Parents | Benzothiazoles 1-hydroxy-2-unsubstituted benzenoids Imidothiolactones Thiazolines Thiazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Alpha-amino acid or derivatives - 1,3-benzothiazole - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Imidothiolactone - Azole - Thiazole - Meta-thiazoline - Heteroaromatic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof. |
| External Descriptors | benzothiazoles - 1,3-thiazolemonocarboxylic acid - imidothioate |
| Solubilidad | DMSO: 10 mg/mL, clear, colorless to faintly yellow |
|---|---|
| Rotación específica [α] | -33° (C=1,DMF) |
| Punto de fusión (°C) | 200°C |
| Peso molecular | 280.300 g/mol |
| XLogP3 | 2.200 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 279.998 Da |
| Monoisotopic Mass | 279.998 Da |
| Topological Polar Surface Area | 136.000 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 390.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Xiaomeng Li, Mengyao Wu, Minquan Xia, Mohamed Salama, Haoyang Sun, Lixian Ding, Xi Huang, Dewei Shu, Zhaoxia Cai. (2024) A promising food-grade protector for Retinyl acetate emulsions with fibrillated egg white. FOOD CHEMISTRY, [PMID:38608602] [10.1016/j.foodchem.2024.139158] |
| 2. Ao Danyi, Peng Dandan, He Cai, Ye Chunjun, Hong Weiqi, Huang Xiya, Lu Yishan, Shi Jie, Zhang Yu, Liu Jian, Wei Xiawei, Wei Yuquan. (2025) A promising mRNA vaccine derived from the JN.1 spike protein confers protective immunity against multiple emerged Omicron variants. Molecular Biomedicine, 6 (1): (1-14). [PMID:40035925] [10.1186/s43556-025-00258-7] |
| 3. Xianghua Zhong, Li Luo, Jiyuan Wu, Weirun Li, Xinyang Liu, Tenghui Ye, Zhenhua Li, Peng Shi. (2025) Adhesion-Assisted Antioxidant-Engineered Mesenchymal Stromal Cells for Enhanced Cardiac Repair in Myocardial Infarction. ACS Nano, [PMID:40073336] [10.1021/acsnano.5c00820] |
| 4. Pingping Fan, Kui Li, Tian Li, Panke Zhang, Shuo Huang. (2024) Nanopore signatures of major alcoholic beverages. Matter, [PMID:] [10.1016/j.matt.2024.11.025] |
| 5. Mao Mu, Nigel Graham, Wenzheng Yu, Kening Sun, Xiyan Xu, Ting Liu. (2024) Optimal cross-linking of MXene-based membranes for high rejection and low adsorption with long-term stability for water treatment. JOURNAL OF MEMBRANE SCIENCE, [PMID:] [10.1016/j.memsci.2024.122738] |
| 6. Tingting Liu, Yao Gu, AL-Ansi Waleed, Mingcong Fan, Li Wang, Yan Li, Haifeng Qian. (2025) Unveiling the relationship between heat-resistant structure characteristics and inhibitory activity in colored highland barley proteinaceous α-amylase inhibitors. FOOD CHEMISTRY, [PMID:39986068] [10.1016/j.foodchem.2025.143401] |
| 7. Zhiqian Wang, Mingcong Fan, Kanza Hannachi, Yan Li, Haifeng Qian, Li Wang. (2023) Impact of red kidney bean protein on starch digestion and exploring its underlying mechanism. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, [PMID:37751820] [10.1016/j.ijbiomac.2023.127023] |
| 8. Ruining Li, Zhiwei Li, Chenxi Huang, Yifeng Ding, Jia Wang, Xiaohong Wang. (2023) Phage-Based Biosensing for Rapid and Specific Detection of Staphylococcus aureus. Microorganisms, 11 (8): (2098). [PMID:37630658] [10.3390/microorganisms11082098] |
| 9. Zhilin Pan, Baolin Ge, Mingjun Wei, Jeevithan Elango, Wenhui Wu. (2023) Isolation and Biochemical Properties of Type II Collagen from Blue Shark (Prionace glauca) Cartilage. Marine Drugs, 21 (5): (260). [PMID:37233454] [10.3390/md21050260] |
| 10. Xinning Yu, Tengjing Xu, Huimin Shi, Jianqiao Hong, Xiaoqiang Jin, Le Cao, Jiajie Wang, Yunting Lin, Zongyou Pan, Siheng Wang, Jinghua Fang, Kaiwang Xu, Hongyun Song, Zhuxing Zhou, Sunan Zhu, Jun Yin, Yiying Qi, Xuesong Dai. (2023) Cartilage-targeting mRNA-lipid nanoparticles rescue perifocal apoptotic chondrocytes for integrative cartilage repair. CHEMICAL ENGINEERING JOURNAL, [PMID:] [10.1016/j.cej.2023.142841] |
| 11. Li Liang, Weiliang Sun, Xiaoxuan Wei, Li Wang, Huaqiang Ruan, Junchuan Zhang, Suyan Li, Bi Zhao, Mengshi Li, Zhengwen Cai, Jie'an Huang. (2023) Oxymatrine suppresses colorectal cancer progression by inhibiting NLRP3 inflammasome activation through mitophagy induction in vitro and in vivo. PHYTOTHERAPY RESEARCH, [PMID:36974424] [10.1002/ptr.7808] |
| 12. Xuehui Wang, Jiaying Wang, Zihui An, Aifen Yang, Mengsheng Qiu, Zhou Tan. (2023) CircXPO1 Promotes Glioblastoma Malignancy by Sponging miR-7-5p. Cells, 12 (6): (831). [PMID:36980172] [10.3390/cells12060831] |
| 13. Hongwei Cao, Qilong Huang, Junru shi, Xiao Guan, Hongdong Song, Yu Zhang, Jian Xie, Yong Fang. (2023) Effect of conventional and microwave heating treatment on antioxidant activity of quinoa protein after simulated gastrointestinal digestion. FOOD CHEMISTRY, [PMID:36870208] [10.1016/j.foodchem.2023.135763] |
| 14. Xiaoyu Du, Shanyu Zhang, Liying Wang, Yuqin Wang, Pingping Fan, Wendong Jia, Panke Zhang, Shuo Huang. (2023) Single-Molecule Interconversion between Chiral Configurations of Boronate Esters Observed in a Nanoreactor. ACS Nano, [PMID:36655995] [10.1021/acsnano.2c11286] |
| 15. Juan Qiao, Qian Ma, Yuying Song, Li Qi. (2022) In Situ Monitoring of Intracellular ATP Variation Based on a Thermoregulated Polymer Nanocomposite. ACS Applied Bio Materials, [PMID:36441583] [10.1021/acsabm.2c00810] |
| 16. Wanyi Dong, Xinyue Zhang, Lixian Ding, Cong Liu, Minhui Ai, Yongguo Jin, Kazuhiro Isobe, Akihiro Handa, Zhaoxia Cai. (2022) Enhancement of emulsification properties by modulation of egg white protein fibril structure with different heating times. FOOD HYDROCOLLOIDS, [PMID:] [10.1016/j.foodhyd.2022.108203] |
| 17. Henghui Zhang, Zhijun Zhang, Dongliang He, Shuying Li, Yongping Xu. (2022) Optimization of Enzymatic Hydrolysis of Perilla Meal Protein for Hydrolysate with High Hydrolysis Degree and Antioxidant Activity. MOLECULES, 27 (3): (1079). [PMID:35164344] [10.3390/molecules27031079] |
| 18. Shunqi Pei, Xuehui Wang, Xuan Wang, Hao Huang, Huaping Tao, Binghua Xie, Aifen Yang, Mengsheng Qiu, Zhou Tan. (2021) Aberrant nuclear lamina contributes to the malignancy of human gliomas. Journal of Genetics and Genomics, [PMID:34530169] [10.1016/j.jgg.2021.08.013] |
| 19. Yiming Liu, Yanan Sun, Minli Yang. (2021) A double-potential ratiometric electrochemiluminescence platform based on g-C3N4 nanosheets (g-C3N4 NSs) and graphene quantum dots for Cu2+ detection. Analytical Methods, 13 (7): (903-909). [PMID:33511388] [10.1039/D0AY02233K] |
| 20. Li Ke, Zhou Yun, Chen Yulong, Zhou Liansuo, Liang Jimin. (2020) A novel natural product, britanin, inhibits tumor growth of pancreatic cancer by suppressing nuclear factor-κB activation. CANCER CHEMOTHERAPY AND PHARMACOLOGY, 85 (4): (699-709). [PMID:32185482] [10.1007/s00280-020-04052-w] |
| 21. Xiaofeng Lu, Dong Zhong, Qi An, Liting Kang, Na Fan, Junjie Cao, Renjie Li, Qianqian Cao, Yudong Zhou, Xiaoyu Du, Shuanghong Yan, Juan Li, Xiaolei Qu, Yuqin Wang. (2025) Multiplex Nanopore Detection of Structurally Diverse Per- and Polyfluoroalkyl Substances in Surface Water. ACS Nano, [PMID:41103273] [10.1021/acsnano.5c12164] |
| 22. Jiulong Yin, Lei Qi, Na Li, Meng Li, Chao Jiang, Yujian Yao, Xuan Zhang. (2025) Brominated monomer-enabled polyester tight ultrafiltration membranes for efficient dye/salt separation and anti-fouling performance. SEPARATION AND PURIFICATION TECHNOLOGY, [PMID:] [10.1016/j.seppur.2025.136009] |
| 23. Zhixin Su, Na Tao, Siren Li, Wenyong Jiang, Miaojia Pan, Hongyuan Zhang, Zhaoxu Wang, Hu Zhou, Tiefan Huang. (2025) Disulfide-mediated in-situ crosslinking of MXene membranes for enhanced stability and precise molecular sieving. SEPARATION AND PURIFICATION TECHNOLOGY, [PMID:] [10.1016/j.seppur.2025.136159] |
| 24. Yunqi Xiao, Shanyu Zhang, Xinmeng Gao, Tian Li, Hanhan Zhang, Panke Zhang, Shuo Huang. (2026) Nanopore profiling and structure determination of oligosaccharides by fragmentation. Science Advances, 12 (1): [PMID:41477834] [10.1126/sciadv.aea8462] |
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