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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 17:41:57 UTC
Update Date2023-02-21 17:20:13 UTC
HMDB IDHMDB0031258
Secondary Accession Numbers
  • HMDB31258
Metabolite Identification
Common NameLenthionine
DescriptionLenthionine belongs to the class of organic compounds known as organic trisulfides. These are organosulfur compounds with the general formula RSSSR' (R,R'=alkyl, aryl). Lenthionine is a mushroom tasting compound. Lenthionine has been detected, but not quantified in, several different foods, such as common mushrooms (Agaricus bisporus), green vegetables, mushrooms, and oyster mushrooms (Pleurotus ostreatus). This could make lenthionine a potential biomarker for the consumption of these foods. Based on a literature review a significant number of articles have been published on Lenthionine.
Structure
Thumb
Synonyms
ValueSource
LenthioninChEBI
1,2,3,5,6-PentathiepaneKegg
1,2,3,5,6-PentathiacycloheptaneHMDB
Chemical FormulaC2H4S5
Average Molecular Weight188.378
Monoisotopic Molecular Weight187.891653578
IUPAC Name1,2,3,5,6-pentathiepane
Traditional Namelenthionine
CAS Registry Number292-46-6
SMILES
C1SSCSSS1
InChI Identifier
InChI=1S/C2H4S5/c1-3-4-2-6-7-5-1/h1-2H2
InChI KeyDZKOKXZNCDGVRY-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as organic trisulfides. These are organosulfur compounds with the general formula RSSSR' (R,R'=alkyl, aryl).
KingdomOrganic compounds
Super ClassOrganosulfur compounds
ClassOrganic trisulfides
Sub ClassNot Available
Direct ParentOrganic trisulfides
Alternative Parents
Substituents
  • Organic trisulfide
  • Organic disulfide
  • Organoheterocyclic compound
  • Hydrocarbon derivative
  • Aliphatic heteromonocyclic compound
Molecular FrameworkAliphatic heteromonocyclic compounds
External Descriptors
Ontology
Physiological effect
Disposition
ProcessNot Available
RoleNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point60 - 61 °CNot Available
Boiling Point287.00 °C. @ 760.00 mm HgThe Good Scents Company Information System
Water Solubility532.7 mg/L @ 25 °C (est)The Good Scents Company Information System
LogP4.238 (est)The Good Scents Company Information System
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
Predicted Chromatographic Properties
Spectra
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB003295
KNApSAcK IDC00001256
Chemspider ID60844
KEGG Compound IDC08382
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkLenthionine
METLIN IDNot Available
PubChem Compound67521
PDB IDNot Available
ChEBI ID6408
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1576921
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .