CHEBI:4488 - diallyl disulfide

Main ChEBI Ontology Automatic Xrefs
ChEBI Name diallyl disulfide
ChEBI ID CHEBI:4488
Definition An organic disulfide where the organic group specified is allyl. It has been isolated from garlic and other species of the genus Allium.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H10S2
Net Charge 0
Average Mass 146.27560
InChI InChI=1S/C6H10S2/c1-3-5-7-8-6-4-2/h3-4H,1-2,5-6H2
InChIKey PFRGXCVKLLPLIP-UHFFFAOYSA-N
SMILES C=CCSSCC=C
Roles Classification
Biological Role(s): antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing diallyl disulfide (CHEBI:4488) has role antifungal agent (CHEBI:35718)
diallyl disulfide (CHEBI:4488) has role antineoplastic agent (CHEBI:35610)
diallyl disulfide (CHEBI:4488) has role plant metabolite (CHEBI:76924)
diallyl disulfide (CHEBI:4488) is a organic disulfide (CHEBI:35489)
IUPAC Name
3-(prop-2-en-1-yldisulfanyl)prop-1-ene
Synonyms Sources
2-propenyl disulphide NIST Chemistry WebBook
3,3'-disulfanediylbis(prop-1-ene) IUPAC
3,3'-dithiobis(prop-1-ene) ChEBI
3-(allyldisulfanyl)-1-propene NIST Chemistry WebBook
4,5-dithia-1,7-octadiene NIST Chemistry WebBook
allyl disulfide NIST Chemistry WebBook
Diallyl disulfide KEGG COMPOUND
diallyl disulphide NIST Chemistry WebBook
Database Links Databases
C00001243 KNApSAcK
C08369 KEGG COMPOUND
Diallyl_disulfide Wikipedia
HMDB33966 HMDB
View more database links
Registry Numbers Types Sources
1699241 Beilstein Registry Number ChemIDplus
1699241 Reaxys Registry Number Reaxys
217847 Gmelin Registry Number Gmelin
2179-57-9 CAS Registry Number ChemIDplus
2179-57-9 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
11375895 PubMed citation CiteXplore
16462049 PubMed citation CiteXplore
17534841 PubMed citation CiteXplore
Last Modified
28 July 2014