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Allicin

CAT: 1568-C09684-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1568-C09684-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
539-86-6
Synonyms
Diallyl thiosulfinate
SKU
C09684-25mg
Target
Fungal
Applications
Microbiology
Molecular Formula
C6H10OS2
Additionnal Information
Allicin (Diallyl Thiosulfinate), the main biologically active component of the freshly crushed garlic extracts, possesses various biological activities including antibacterial, antifungal and antiparasitic effects., Allicin (Diallyl Thiosulfinate), the main biologically active component of the freshly crushed garlic extracts, possesses various biological activities including antibacterial, antifungal and antiparasitic effects.
Storage Conditions
2 years -20°C liquid

Chemical Information

Allicin

Allicin is a sulfoxide and a botanical anti-fungal agent. It has a role as an antibacterial agent.

CAS Number539-86-6
PubChem CID65036
IUPAC Name3-prop-2-enylsulfinylsulfanylprop-1-ene
Molecular FormulaC6H10OS2
Molecular Weight162.3
XLogP1.3
Topological Polar Surface Area61.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count9
Formal Charge0
Complexity120
SMILES
C=CCSS(=O)CC=C
InChI
InChI=1S/C6H10OS2/c1-3-5-8-9(7)6-4-2/h3-4H,1-2,5-6H2
InChIKey
JDLKFOPOAOFWQN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Allicin
CAS: 539-86-6
CID: 65036
Formula: C6H10OS2
MW: 162.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight162.3
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass162.01730729
Monoisotopic Mass162.01730729
Topological Polar Surface Area61.6 Ų
Heavy Atom Count9
Formal Charge0
Complexity120
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes