Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥95% Moligand™ 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 14 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Product Introduction
Sulforaphane is a naturally occurring isothiocyanate found in cruciferous vegetables such as broccoli, cabbage, kale.It is an inducer of Nrf2.Sulforaphane is also an inhibitor of histone deacetylase (HDAC) and NF - κ B.Sulforaphane increases heme oxygenase-1 (HO-1) and decreases the levels of reactive oxygen species (ROS).Sulforaphane induces cell cycle arrest and apoptosis.
Application
LNCaP prostate cancer cells were treated with DL sulforaphane to investigate its effect on androgen receptor.Treatment of rats with DL sulforaphane was used to study its effect on malathion toxicity.
| Sonrisas canónicas | CS(=O)CCCCN=C=S |
|---|---|
| IUPAC Name | 1-isothiocyanato-4-methylsulfinylbutane |
| InChIKey | SUVMJBTUFCVSAD-UHFFFAOYSA-N |
| INCHI | 1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3 |
| Isómeros SMILES | CS(=O)CCCCN=C=S |
| WGK Alemania | 3 |
| Peso molecular | 177.29 |
| Reaxy-Rn | 1723237 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1723237&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 | Organosulfur compounds |
| Clase | Sulfoxides |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Sulfoxides |
| Alternative Parents | Isothiocyanates Sulfinyl compounds Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Sulfoxide - Isothiocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfinyl compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as sulfoxides. These are compounds containing a sulfoxide functional group, with the structure RS(=O)R' (R,R' not H). |
| External Descriptors | sulfoxide - isothiocyanate |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Jun 11, 2026 | S111997 | |
| Certificate of Analysis | Jun 11, 2026 | S111997 | |
| Certificate of Analysis | Oct 13, 2025 | S111997 | |
| Certificate of Analysis | Oct 13, 2025 | S111997 | |
| Certificate of Analysis | Aug 12, 2025 | S111997 | |
| Certificate of Analysis | Jul 27, 2022 | S111997 | |
| Certificate of Analysis | Jul 27, 2022 | S111997 | |
| Certificate of Analysis | Jul 27, 2022 | S111997 | |
| Certificate of Analysis | Dec 29, 2021 | S111997 | |
| Certificate of Analysis | Dec 29, 2021 | S111997 | |
| Certificate of Analysis | Dec 29, 2021 | S111997 |
| Solubilidad | Soluble in Chloroform, Dichloromethane, Diethyl Ether, methanol and DMSO, Soluble in Chloroform, Dichloromethane, Diethyl Ether, methanol and DMSO |
|---|---|
| Sensibilidad | Moisture & light sensitive |
| Peso molecular | 177.300 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 177.028 Da |
| Monoisotopic Mass | 177.028 Da |
| Topological Polar Surface Area | 80.700 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 152.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Ao-Chun Yue, Xu-Dong Zhou, Hui-Ping Song, Xu-Han Liu, Ming-Jun Bi, Wei Han, Qin Li. (2023) Effect and molecular mechanism of Sulforaphane alleviates brain damage caused by acute carbon monoxide poisoning:Network pharmacology analysis, molecular docking, and experimental evidence. ENVIRONMENTAL TOXICOLOGY, [PMID:37860845] [10.1002/tox.24000] |
| 2. Guangyang Liu, Xuan Zhang, Jian Wang, Lingyun Li, Jiayong Cao, Chen Yin, Yuan Liu, Ge Chen, Jun Lv, Xiaomin Xu, Jing Wang, Xiaodong Huang, Donghui Xu. (2023) Facile preparation of biomimetic mineralized COFs based on magnetic silk fibroin and its effective extraction of sulforaphane from cruciferous vegetables. FOOD CHEMISTRY, [PMID:37722339] [10.1016/j.foodchem.2023.137482] |
| 3. Linlin Jia, Xiaoqiang Peng, Zeyuan Deng, Bing Zhang, Hongyan Li. (2023) The structural characterization of polysaccharides from three cultivars of Moringa oleifera Lam. root and their effects on human intestinal microflora. Food Bioscience, [PMID:] [10.1016/j.fbio.2023.102482] |
| 4. Wenxiu Zheng, Wenhao Wang, Desheng Fu, Tianyu Zhang, Zhengrui Liang, Ling Yan, Changhong Liu, Lei Zheng. (2022) Microwave bag cooking affects the quality, glucosinolates content and hydrolysate production of broccoli florets. FOOD RESEARCH INTERNATIONAL, [PMID:36738020] [10.1016/j.foodres.2022.112401] |
| 5. Qi Zhang, Wanshuang Cao, Chenying Yang, Lixia Hong, Shanshan Geng, Hongyu Han, Caiyun Zhong. (2022) Isothiocyanates attenuate immune checkpoint blockage therapy in gastric cancer via induction of PD-L1 expression. JOURNAL OF NUTRITIONAL BIOCHEMISTRY, [PMID:36435292] [10.1016/j.jnutbio.2022.109226] |
| 6. Shaoqing Chen, Ziyu Wang, Li Liu, Yuting Li, Xinye Ni, Hong Yuan, Cheng Wang. (2022) Redox homeostasis modulation using theranostic AIE nanoparticles results in positive-feedback drug accumulation and enhanced drug penetration to combat drug-resistant cancer. Materials Today Bio, [PMID:36060105] [10.1016/j.mtbio.2022.100396] |
| 7. Yun Liu, Xue Wang, Bo Si, Tong Wang, Yun Wu, Ying Liu, Yemian Zhou, Haiyang Tong, Xinwei Zheng, An Xu. (2022) Zinc oxide/graphene oxide nanocomposites efficiently inhibited cadmium-induced hepatotoxicity via releasing Zn ions and up-regulating MRP1 expression. ENVIRONMENT INTERNATIONAL, [PMID:35667343] [10.1016/j.envint.2022.107327] |
| 8. Xi Zhao, Zhenhua Liu, Jie Gao, Hu Li, Xiaorong Wang, Yinchuan Li, Fei Sun. (2020) Inhibition of ferroptosis attenuates busulfan-induced oligospermia in mice. TOXICOLOGY, [PMID:32416107] [10.1016/j.tox.2020.152489] |
| 9. Xianghui Huang, Jia Xu, Ye Xu, Bingxin Huangfu, Feng Zhang, Yanzhou Hu, Ruxin Gao, Xinxin Ren, Boyang Zhang, Kunlun Huang, Xiaoyun He. (2024) Sulforaphane ameliorates non-alcoholic steatohepatitis by KLF4-mediated macrophage M2 polarization. Food Science and Human Wellness, [PMID:] [10.26599/FSHW.2022.9250220] |
| 10. Qilei Wang, Zhenzhen Feng, Chan Shi, Xingang Lyu, DaiDi Fan. (2024) Sulforaphane nanoparticles coated with zein-propylene glycol alginate attenuate N-diethylnitrosamine-induced liver injury in mice. JOURNAL OF FOOD SCIENCE, 89 (10): (6707-6719). [PMID:39218937] [10.1111/1750-3841.17156] |
| 11. Shuling He, Lvyun Sun, Jiali Chen, Yixin Li, Ying Pan, Amei Su, Qiuyao Mao, Jiaqian Hu, Disheng Feng, Yang Ouyang. (2025) Therapeutic Effects of Sulforaphane on Helicobacter pylori-Infected Mice: Insights from High-Coverage Metabolomics and Lipidomics Analyses of Serum and Liver. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 26 (16): (7791). [PMID:40869112] [10.3390/ijms26167791] |
| 12. Shiping Yang, Leyuan Feng, Junliang Luo, Jichang Jian, Shuanghu Cai, Huiling Liu. (2025) Sulforaphane Repairs Oxidative Stress Damage Induced by Oxidized Fish Oil by Activating Nrf2 in Litopenaeus vannamei. AQUACULTURE NUTRITION, 2025 (1): (6665220). [PMID:40923044] [10.1155/anu/6665220] |
| 13. Xing Li, Jipeng Zhang, Xiangyu Liu, Zijian Wu, Zhipeng Yu, Wen Zhang, Yuanzhi Wang, Zekun Li, Martien A. Cohen Stuart, Leonard M.C. Sagis, Minchun Lv, Jie Xiao, Yuan Li. (2025) Gastric-mucus penetrating and responsive microgels for alleviating Helicobacter pylori-induced gastritis. JOURNAL OF CONTROLLED RELEASE, [PMID:40288498] [10.1016/j.jconrel.2025.113741] |
| 14. Liyan Yao, Xinhua Pu, Yuanlin Wu, Ke Zhang, Alexander Berestetskiy, Qiongbo Hu, Qunfang Weng. (2025) An Optimized Bioassay System for the Striped Flea Beetle, Phyllotreta striolata. Insects, 16 (5): (510). [PMID:40429223] [10.3390/insects16050510] |
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