3-(prop-2-en-1-ylsulfinyl)alanine
Alliin
CAS: 556-27-4;17795-27-6
Molecular Formula: C6H11NO3S
3-(prop-2-en-1-ylsulfinyl)alanine - Names and Identifiers
| Name | Alliin |
| Synonyms | Alliin Alliin (25 mg) (S)-3-(Allylsulphiny 3-(Allylsulfinyl)alanin S-Allyl-L-cystein-S-oxid S-ALLYL-L-CYSTEINESULPHOXIDE (S)-L-3-(Allylsulfinyl)alanine (S)-3-(Allylsulphinyl)-L-alanine 3-(prop-2-en-1-ylsulfinyl)alanine 3-(prop-2-en-1-ylsulfinyl)-L-alanine L-Alanine, 3-(2-propenylsulfinyl)-, (S)- |
| CAS | 556-27-4 17795-27-6 |
| EINECS | 209-118-9 |
| InChI | InChI=1/C6H11NO3S/c1-2-3-11(10)4-5(7)6(8)9/h2,5H,1,3-4,7H2,(H,8,9)/t5-,11?/m0/s1 |
| InChIKey | XUHLIQGRKRUKPH-DYEAUMGKSA-N |
3-(prop-2-en-1-ylsulfinyl)alanine - Physico-chemical Properties
| Molecular Formula | C6H11NO3S |
| Molar Mass | 177.22 |
| Density | 1.205 (estimate) |
| Melting Point | 164-166° (effervescence) |
| Boling Point | 416.1±45.0 °C(Predicted) |
| Specific Rotation(α) | D20 +63.5° (c = 2) |
| Flash Point | 205.5°C |
| Solubility | Water Soluble |
| Vapor Presure | 4.32E-08mmHg at 25°C |
| Appearance | Colorless massive crystal |
| Merck | 13,259 |
| pKa | 1.88±0.10(Predicted) |
| Storage Condition | Keep in dark place,Inert atmosphere,Store in freezer, under -20°C |
| Refractive Index | 1.5500 (estimate) |
| MDL | MFCD01311056 |
| Physical and Chemical Properties | Colorless block Crystal, soluble in methanol, ethanol, DMSO and other organic solvents, from garlic. |
3-(prop-2-en-1-ylsulfinyl)alanine - Risk and Safety
| Hazard Symbols | Xi - Irritant |
| Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. |
| WGK Germany | 3 |
| FLUKA BRAND F CODES | 8-10 |
| HS Code | 29309090 |
3-(prop-2-en-1-ylsulfinyl)alanine - Reference
| Reference Show more | 1. Li Ming-Qiang, Hu Ming, Song delete, etc. Study on efficient separation and extraction of alliin [J]. Modern medicine and health, 2017, 33(019):2937-2940. 2. Li Mingqiang, Hu Ming, Han Zhijun, etc. Pharmacokinetics of alliin in rabbits [J]. Modern medicine and health, 2018. 3. [IF = 5.309] Limin Shi et al."Allilin, a garlic organosulfur compound, ameliorates gut inflation through MAPK-nf‐κb/ap‐1/STAT -1 inactivation and PPAR-gamma activation." Mol Nutr Food Res. 2017 Sep;61(9):1601013 4. [IF = 3.738] Yi-luan Wang et al."Effects of alliin on LPS-induced acute lung injury by activating PPARγ."Microb Pathogenesis. 2017 Sep;110:375 5. [IF=4.35] Xiaomei Dai et al."1-Methylcyclopropene Preserves the Quality of Chive (Allium schoenoprasum L.) by Enhancing Its Antioxidant Capacities and Organosulfur Profile during Storage."Foods. 2021 Aug;10(8):1792 6. [IF=6.023] Meitong Liu et al."Alliin alleviates LPS-induced pyroptosis via promoting mitophagy in THP-1 macrophages and mice."Food Chem Toxicol. 2022 Feb;160:112811 7. [IF=3.463] Xiaomei Dai et al."S-alk(en)ylcysteine sulfoxides biosynthesis and free amino acids profile in different parts of postharvest chive (Allium schoenoprasum L.)."SCIENTIA HORTICULTURAE. 2022 Sep;303:111191 |
3-(prop-2-en-1-ylsulfinyl)alanine - Reference Information
| Plant Source: | garlic |
| Overview | alliin is a substance found and extracted from garlic, with a wide range of biological activities: against Staphylococcus aureus, mycobacterium tuberculosis, Meningococcus and other common pathogenic bacteria have a strong killing effect, the fungal infection, protozoal disease and other microbial infectious diseases have a significant effect; In addition, in lowering blood lipids, improving human immunity, anti-aging, anti-cancer and other aspects also have a good effect. |
| biological activity | Alliin, an orally active sulfoxide compound extracted from garlic, antioxidant and anti-inflammatory activity. |
| Use | alliin has the function of protecting liver, antibacterial and reducing blood lipid. for content determination/identification/pharmacological experiments. |
Last Update：2024-04-09 20:52:54
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