CAS Number3952-98-5
Synonyms(−)-Sinigrin hydrate; Allyl glucosinolate; Kalium-1-S-[(1Z)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose; Myronate Potassium; 1-Thio-b-D-glucopyranose 1-[N-(Sulfooxy)-3-butenimidate] Monopotassium Salt; Potassium Myronate; Potassium 1-S-[(1Z)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose; MFCD00149447; Sinigroside; EINECS 223-545-8; Potassium 1-S-[(1E)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose hydrate (1:1:1); 1-S-[(1Z)-N-(Sulfonatooxy)-3-butènan-1-imidoyl]-1-thio-β-D-glucopyranose de potassium; Sinigrin Hydrate; Sinigrin; Potassium 1-S-[(1Z)-N-(sulfonatooxy)but-3-enimidoyl]-1-thio-β-D-glucopyranose; β-D-Glucopyranose, 1-S-[(1Z)-1-[(sulfooxy)imino]-3-buten-1-yl]-1-thio-, potassium salt (1:1)
Molecular FormulaC10H16KNO9S2
Molecular Weight415.479
Melting Point128 (dec.)(lit.)ºC
AppearanceWhite to beige crystalline powder
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 3952-98-5 |
| Catalog No. | 2A-0202773 |
| Chinese Name | 黑介子苷 |
| Synonyms | (−)-Sinigrin hydrate; Allyl glucosinolate; Kalium-1-S-[(1Z)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose; Myronate Potassium; 1-Thio-b-D-glucopyranose 1-[N-(Sulfooxy)-3-butenimidate] Monopotassium Salt; Potassium Myronate; Potassium 1-S-[(1Z)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose; MFCD00149447; Sinigroside; EINECS 223-545-8; Potassium 1-S-[(1E)-N-(sulfonatooxy)-3-butenimidoyl]-1-thio-β-D-glucopyranose hydrate (1:1:1); 1-S-[(1Z)-N-(Sulfonatooxy)-3-butènan-1-imidoyl]-1-thio-β-D-glucopyranose de potassium; Sinigrin Hydrate; Sinigrin; Potassium 1-S-[(1Z)-N-(sulfonatooxy)but-3-enimidoyl]-1-thio-β-D-glucopyranose; β-D-Glucopyranose, 1-S-[(1Z)-1-[(sulfooxy)imino]-3-buten-1-yl]-1-thio-, potassium salt (1:1) |
| Molecular Formula | C10H16KNO9S2 |
| Molecular Weight | 415.479 |
| Melting Point | 128 (dec.)(lit.)ºC |
| Appearance | White to beige crystalline powder |
| Water Solubility | almost transparency |
| Storage Condition | Store at room temperature, away from light, in a v |
| Application | Sinigrin is the major glucosinolate found in the Brassicaceae family and has anti-adipogenic effects. |
| HTC | 29389090 |
| PubChem ID | 15965206 |
| SMILES | C=CCC(=NOS(=O)(=O)[O-])SC1OC(CO)C(O)C(O)C1O.[K+] |
| InChI | InChI=1S/C10H17NO9S2.K/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);/q;+1/p-1/b11-6+;/t5-,7-,8+,9-,10+;/m1./s1 |
| InChI Key | QKFAFSGJTMHRRY-FVDOMRANSA-M |
| Hazard Symbols | transportation |
| Bioactivity | Sinigrin is a major glucosinolate present in plants of the Brassicaceae family, with anti-adipogenic effects[1]. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Metabolic Disease References [1]. Lee HW, et al. Inhibitory effect of sinigrin on adipocyte differentiation in 3T3-L1 cells: Involvement of AMPK and MAPK pathways. Biomed Pharmacother. 2018 Jun;102:670-680. Chemical & Physical Properties Melting Point 128 (dec.)(lit.)ºC Molecular Formula C10H16KNO9S2 Molecular Weight 415.479 Exact Mass 415.000916 PSA 202.62000 InChIKey QKFAFSGJTMHRRY-FVDOMRANSA-M SMILES C=CCC(=NOS(=O)(=O)[O-])SC1OC(CO)C(O)C(O)C1O.[K+] Water Solubility almost transparency |
| Use of | Sinigrin is a major glucosinolate present in plants of the Brassicaceae family, with anti-adipogenic effects[1]. Properties Articles27 Name sinigrin Synonym More Synonyms Sinigrin Biological Activity Description Sinigrin is a major glucosinolate present in plants of the Brassicaceae family, with anti-adipogenic effects[1]. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Metabolic Disease References Chemical & Physical Properties Molecular Formula C10H16KNO9S2 Exact Mass 415.000916 PSA 202.62000 InChIKey QKFAFSGJTMHRRY-FVDOMRANSA-M SMILES C=CCC(=NOS(=O)(=O)[O-])SC1OC(CO)C(O)C(O)C1O.[K+] Water Solubility almost transparency |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available |
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