Record Information
Version1.0
Creation date2010-04-08 22:13:29 UTC
Update date2019-11-26 03:15:39 UTC
Primary IDFDB018071
Secondary Accession Numbers
  • FDB018894
Chemical Information
FooDB NameS-Methyl-L-methionine chloride
Description(±)-s-methylmethionine chloride, also known as mmsc or methionylmethylsulfonium chloride, belongs to methionine and derivatives class of compounds. Those are compounds containing methionine or a derivative thereof resulting from reaction of methionine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom (±)-s-methylmethionine chloride is slightly soluble (in water) and a moderately acidic compound (based on its pKa).
CAS Number1115-84-0
Structure
Thumb
Synonyms
SynonymSource
(1)-(3-Amino-3-carboxypropyl)dimethylsulphonium chloridebiospider
(S)-(3-Amino-3-carboxypropyl)dimethylsulfonium chloridebiospider
Cabagin Udb_source
Epadyn Udb_source
Methionine methylsulfonium chloridebiospider
Methionylmethylsulfonium chloridebiospider
Methylmethionine sulfonium chloridebiospider
Methylmethioninesulfonium chloridebiospider
MMSCdb_source
S-Methyl-L-methionine chloridemanual
S-Methylmethioninium chloridebiospider
S-Methylmethionyl chloridedb_source
Sulfonium, (3-amino-3-carboxypropyl)dimethyl-, chloridebiospider
Sulfonium, (3-amino-3-carboxypropyl)dimethyl-, chloride, L-biospider
Sulfonium, (3-carboxy-3-aminopropyl)dimethyl-, chloridebiospider
Vitamin Udb_source
Vitas Udb_source
Predicted PropertiesNot Available
Chemical FormulaC6H14ClNO2S
IUPAC name
InChI IdentifierInChI=1S/C6H13NO2S.ClH/c1-10(2)4-3-5(7)6(8)9;/h5H,3-4,7H2,1-2H3;1H
InChI KeyMYGVPKMVGSXPCQ-UHFFFAOYSA-N
Isomeric SMILES[Cl-].C[S+](C)CCC(N)C(O)=O
Average Molecular Weight199.699
Monoisotopic Molecular Weight199.043377094
Classification
ClassificationNot classified
Ontology
Disposition

Source:

Biological location:

Role

Industrial application:

Biological role:

Physico-Chemical Properties - Experimental
Physico-Chemical Properties - Experimental
PropertyValueReference
Physical stateNot Available
Physical DescriptionNot Available
Mass CompositionC 36.09%; H 7.07%; Cl 17.75%; N 7.01%; O 16.02%; S 16.06%DFC
Melting PointMp 139° dec.DFC
Boiling PointNot Available
Experimental Water SolubilityNot Available
Experimental logPNot Available
Experimental pKaNot Available
Isoelectric pointNot Available
ChargeNot Available
Optical RotationNot Available
Spectroscopic UV DataNot Available
DensityNot Available
Refractive IndexNot Available
Spectra
Spectra
EI-MS/GC-MSNot Available
MS/MSNot Available
NMRNot Available
ChemSpider IDNot Available
ChEMBL IDNot Available
KEGG Compound IDC04078
Pubchem Compound IDNot Available
Pubchem Substance IDNot Available
ChEBI IDNot Available
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDNot Available
CRC / DFC (Dictionary of Food Compounds) IDLFG78-E:LFG80-Z
EAFUS IDNot Available
Dr. Duke IDVIT-U
BIGG IDNot Available
KNApSAcK IDNot Available
HET IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
Flavornet IDNot Available
GoodScent IDrw1036201
SuperScent IDNot Available
Wikipedia IDNot Available
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
FoodReference
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
EnzymesNot Available
PathwaysNot Available
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
Flavours
FlavorCitations
malty
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
tomato
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
potato
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
sulfury
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
green
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
Files
MSDSNot Available
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference— Duke, James. 'Dr. Duke's Phytochemical and Ethnobotanical Databases. United States Department of Agriculture.' Agricultural Research Service, Accessed April 27 (2004).