CHEBI:45758 - dipropyl disulfide

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ChEBI Name dipropyl disulfide
ChEBI ID CHEBI:45758
Definition An organic disulfide where the alkyl groups specified are propyl. It is a component of the essential oils obtained from Allium.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:45756, CHEBI:4651
Supplier Information
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Formula C6H14S2
Net Charge 0
Average Mass 150.30736
Monoisotopic Mass 150.05369
InChI InChI=1S/C6H14S2/c1-3-5-7-8-6-4-2/h3-6H2,1-2H3
InChIKey ALVPFGSHPUPROW-UHFFFAOYSA-N
SMILES CCCSSCCC
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dipropyl disulfide (CHEBI:45758) has role plant metabolite (CHEBI:76924)
dipropyl disulfide (CHEBI:45758) is a organic disulfide (CHEBI:35489)
IUPAC Name
1-(propyldisulfanyl)propane
Synonyms Sources
1,1'-dithiodipropane ChEBI
4,5-dithiaoctane NIST Chemistry WebBook
di-n-propyl disulfide ChemIDplus
Dipropyl disulfide KEGG COMPOUND
dipropyl disulphide NIST Chemistry WebBook
n-Propyl disulfide KEGG COMPOUND
propyl disulfide NIST Chemistry WebBook
Manual Xrefs Databases
C00001247 KNApSAcK
C08373 KEGG COMPOUND
HMDB0031472 HMDB
SSP PDBeChem
View more database links
Registry Numbers Types Sources
142203 Gmelin Registry Number Gmelin
629-19-6 CAS Registry Number ChemIDplus
629-19-6 CAS Registry Number NIST Chemistry WebBook
969200 Beilstein Registry Number Beilstein
969200 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
15279303 PubMed citation Europe PMC
18098065 PubMed citation Europe PMC
22610968 PubMed citation Europe PMC
24370661 PubMed citation Europe PMC
Last Modified
23 October 2015