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Allyl methyl trisulfide (Standard)

CAT: 0804-HY-134900RSize: 1 EachDry Ice: NoHazardous: No
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Description
Allyl methyl trisulfide (Standard) is the analytical standard of Allyl methyl trisulfide. This product is intended for research and analytical applications. Allyl methyl trisulfide is a volatile organic compound and a component of garlic (Allium sativum L.) essential oil, which has antibacterial, antioxidant and antitumor activities[1].
CAS Number
34135-85-8
UNSPSC
12352100
Target
Reactive Oxygen Species (ROS) ; Reference Standards
Related Pathways
Immunology/Inflammation; Metabolic Enzyme/Protease; NF-κB; Others
Field of Research
Infection; Metabolic Disease
Smiles
CSSSCC=C
Molecular Formula
C4H8S3
Molecular Weight
152.30
References & Citations
[1]Kathiroli Sujithra, et al. Allyl methyl sulfide, an organosulfur compound alleviates hyperglycemia mediated hepatic oxidative stress and inflammation in streptozotocin - induced experimental rats. Biomed Pharmacother. 2018 Nov;107:292-302.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Methylallyl trisulfide

platelet aggregation inhibitor in garlic

CAS Number34135-85-8
PubChem CID61926
IUPAC Name3-(methyltrisulfanyl)prop-1-ene
Molecular FormulaC4H8S3
Molecular Weight152.3
XLogP2
Topological Polar Surface Area75.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count7
Formal Charge0
Complexity44
SMILES
CSSSCC=C
InChI
InChI=1S/C4H8S3/c1-3-4-6-7-5-2/h3H,1,4H2,2H3
InChIKey
JGMPRNFEEAJLAJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methylallyl trisulfide
CAS: 34135-85-8
CID: 61926
Formula: C4H8S3
MW: 152.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight152.3
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass151.97881378
Monoisotopic Mass151.97881378
Topological Polar Surface Area75.9 Ų
Heavy Atom Count7
Formal Charge0
Complexity44.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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