CAS Number556-27-4
SynonymsMFCD01311056; (+)-L-Alliin; (2R)-3-(Allylsulfinyl)-2-aminopropanoic acid; (±)-S-2-propenyl-L-cysteine sulfoxide; alliin; 3-((S)-allylsulfinyl)-L-alanine; 3-(Allylsulfinyl)-L-alanine; Einecs 209-118-9; alliin zwitterion; 3-(2-Propèn-1-ylsulfinyl)-L-alanine; 3-(prop-2-en-1-ylsulfinyl)-L-alanine; S-Allyl-L-cysteine Sulfoxide; (S)-3-(Allylsulphiny; 3-[(S)-Allylsulfinyl]-L-alanine; L-(+)-S-2-(propenyl)cysteine sulfoxide; ALLIIN(P); 3-(2-Propenylsulfinyl)-L-alanine; (2R)-2-amino-3-[(S)-prop-2-enylsulfinyl]propanoic acid
Molecular FormulaC6H11NO3S
Molecular Weight177.22
Purity≥95.0 (HPLC)%
Density1.4±0.1 g/cm3
Boiling Point416.1±45.0 °C at 760 mmHg
Melting Point165ºC
AppearanceWhite to off-white crystalline powder
EINECS209-118-9
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 556-27-4 |
| Catalog No. | 2A-9022885 |
| Chinese Name | 蒜氨酸; 蒜碱 |
| Synonyms | MFCD01311056; (+)-L-Alliin; (2R)-3-(Allylsulfinyl)-2-aminopropanoic acid; (±)-S-2-propenyl-L-cysteine sulfoxide; alliin; 3-((S)-allylsulfinyl)-L-alanine; 3-(Allylsulfinyl)-L-alanine; Einecs 209-118-9; alliin zwitterion; 3-(2-Propèn-1-ylsulfinyl)-L-alanine; 3-(prop-2-en-1-ylsulfinyl)-L-alanine; S-Allyl-L-cysteine Sulfoxide; (S)-3-(Allylsulphiny; 3-[(S)-Allylsulfinyl]-L-alanine; L-(+)-S-2-(propenyl)cysteine sulfoxide; ALLIIN(P); 3-(2-Propenylsulfinyl)-L-alanine; (2R)-2-amino-3-[(S)-prop-2-enylsulfinyl]propanoic acid |
| Molecular Formula | C6H11NO3S |
| Molecular Weight | 177.22 |
| Purity | ≥95.0 (HPLC) |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 416.1±45.0 °C at 760 mmHg |
| Melting Point | 165ºC |
| Appearance | White to off-white crystalline powder |
| Storage Condition | −20°C |
| Application | Alliin, an orally active sulfoxide compound extracted from garlic, has hypoglycemic, antioxidant and anti-inflammatory activities. |
| EINECS | 209-118-9 |
| HTC | 2942000000 |
| MDL Number | MFCD00151977 |
| SMILES | N[C@@H](CS(=O)CC=C)C(O)=O |
| InChI | 1S/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 |
| InChI Key | XUHLIQGRKRUKPH-ITZCMCNPSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 85151701 |
| Hazard Symbols | Xi |
| Risk Codes | R36/37/38 |
| Safety Description | S26 |
| MSDS | msds/22885_1_556_27_4.pdf |
| Use of | Alliin, an orally active sulfoxide compound derived from garlic, exhibits hypoglycemic, antioxidant and anti-inflammatory activities[1][2]. Properties Articles17 Name (S)-3-(Allylsulphinyl)-L-alanine Synonym More Synonyms Alliin Biological Activity Description Alliin, an orally active sulfoxide compound derived from garlic, exhibits hypoglycemic, antioxidant and anti-inflammatory activities[1][2]. Related Catalog Research Areas >> Cardiovascular Disease Signaling Pathways >> Others >> Others Research Areas >> Inflammation/Immunology References Chemical & Physical Properties Molecular Formula C6H11NO3S Exact Mass 177.045959 PSA 99.60000 LogP -0.48 Index of Refraction 1.579 InChIKey XUHLIQGRKRUKPH-DYEAUMGKSA-N SMILES C=CCS(=O)CC(N)C(=O)O Safety Information Signal Word Warning Hazard Statements H315-H319-H335 Precautionary Statements P261-P305 + P351 + P338 Hazard Codes Xi:Irritant; Safety Phrases S26 RIDADR NONH for all modes of transport WGK Germany 3 HS Code 2942000000 Synthetic Route Total: 1 Page S-Allyl-L-cysteine CAS#:21593-77-1 CAS#:556-27-4 Literature: Ripp, Sharon L.; Overby, Lila H.; Philpot, Richard M.; Elfarra, Adnan A. Molecular Pharmacology, 1997 , vol. 51, # 3 p. 507 - 515 s-allyl-l-cysteine CAS#:49621-03-6 CAS#:556-27-4 Literature: Helvetica Chimica Acta, , vol. 34, p. 481,486 Helvetica Chimica Acta, , vol. 31, p. 189,207 Precursor & DownStream Precursor 2 CAS#:21593-77-1 S-Allyl-L-cysteine CAS#:49621-03-6 s-allyl-l-cysteine DownStream 7 CAS#:539-86-6 CAS#:127-17-3 Pyruvic acid CAS#:17795-24-3 (2R)-2-amino-3-... CAS#:23127-41-5 N-Acetyl-S-ally... |
| Transport Info | Product name: Alliin |
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