Chemical Property of 1-Isothiocyanato-6-(methylsulfinyl)hexane
Chemical Property:
- Boiling Point:385.9±25.0 °C(Predicted)
- PSA：80.73000
- Density:1.12±0.1 g/cm3(Predicted)
- LogP:2.89380
- Storage Temp.:Refrigerator, under inert atmosphere
- Solubility.:Chloroform (Sparingly), Methanol (Slightly)
- XLogP3:2.1
- Hydrogen Bond Donor Count:0
- Hydrogen Bond Acceptor Count:4
- Rotatable Bond Count:7
- Exact Mass:205.05950645
- Heavy Atom Count:12
- Complexity:176
- Purity/Quality:
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97% *data from raw suppliers
6-MethylsulfinylhexylIsothiocyanate *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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Useful:
- Canonical SMILES:CS(=O)CCCCCCN=C=S
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Description
6-Methylsulfinylhexyl isothiocyanate (6-MSITC) is an isothiocyanate that has been found in wasabi (W. japonica) and has diverse biological activities. It inhibits nitric oxide (NO) production in mouse peritoneal exudate macrophages when used at a concentration of 5 μM. It inhibits aggregation of isolated human platelets induced by arachidonic acid (Item Nos. 90010 | 90010.1 | 10006607; IC50 = 21.9 μM). 6-MSITC reduces cell survival in a panel of breast, brain, colon, lung, ovarian, renal, and prostate cancer cell lines (mean IC50 = 43.7 μM). In vivo, 6-MSITC (5 mg/kg twice weekly) reduces apoptosis of substantia nigral dopaminergic neurons and motor dysfunction in a mouse model of Parkinson''s disease induced by 6-OHDA . 6-MSITC also reduces the number of lung metastases in a B16/F10 murine melanoma model.
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Uses
6-(Methylsulfinyl)hexyl isothiocyanate derived from Wasabia japonica was discovered as an inhibitor of glycogen synthase kinase-3β.
