Methylmethionine chloride
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This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- Methylmethionine chloride
- DrugBank Accession Number
- DB13250
- Background
Methylmethionine chloride may be useful in helping the healing of gastric ulcers. In Japan, it is used as an over the counter product for gastrointestinal health support. It is also called "Vitamin U", but it is not a true vitamin.
- Type
- Small Molecule
- Groups
- Experimental
- Structure
- Weight
- Average: 199.69
Monoisotopic: 199.0433776 - Chemical Formula
- C6H14ClNO2S
- Synonyms
- Methiosulfonium chloride
Pharmacology
- Indication
Not Available
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- Pharmacodynamics
Not Available
- Mechanism of action
- Not Available
- Absorption
Not Available
- Volume of distribution
Not Available
- Protein binding
Not Available
- Metabolism
- Not Available
- Route of elimination
Not Available
- Half-life
Not Available
- Clearance
Not Available
- Adverse Effects
- Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.
- Toxicity
Not Available
- Pathways
- Not Available
- Pharmacogenomic Effects/ADRs
- Not Available
Interactions
- Drug Interactions
- This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.Not Available
- Food Interactions
- Not Available
Categories
- ATC Codes
- A02BX04 — Methiosulfonium chloride
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as methionine and derivatives. These 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.
- Kingdom
- Organic compounds
- Super Class
- Organic acids and derivatives
- Class
- Carboxylic acids and derivatives
- Sub Class
- Amino acids, peptides, and analogues
- Direct Parent
- Methionine and derivatives
- Alternative Parents
- L-alpha-amino acids / Thia fatty acids / Amino acids / Monocarboxylic acids and derivatives / Carboxylic acids / Organosulfur compounds / Organopnictogen compounds / Organic oxides / Organic chloride salts / Monoalkylamines show 2 more
- Substituents
- Aliphatic acyclic compound / Alpha-amino acid / Amine / Amino acid / Carbonyl group / Carboxylic acid / Fatty acid / Fatty acyl / Hydrocarbon derivative / L-alpha-amino acid show 14 more
- Molecular Framework
- Aliphatic acyclic compounds
- External Descriptors
- organic molecular entity (CHEBI:6884)
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- G9CUR2204U
- CAS number
- 1115-84-0
- InChI Key
- MYGVPKMVGSXPCQ-JEDNCBNOSA-N
- InChI
- InChI=1S/C6H13NO2S.ClH/c1-10(2)4-3-5(7)6(8)9;/h5H,3-4,7H2,1-2H3;1H/t5-;/m0./s1
- IUPAC Name
- [(3S)-3-amino-3-carboxypropyl]dimethylsulfanium chloride
- SMILES
- [Cl-].C[S+](C)CC[C@H](N)C(O)=O
References
- General References
- Not Available
- External Links
- KEGG Compound
- C04078
- ChemSpider
- 16736395
- ChEBI
- 6884
- ChEMBL
- CHEMBL1797128
Clinical Trials
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
- Not Available
- Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Not Available
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 9.2 mg/mL ALOGPS logP -1.4 ALOGPS logP -3.3 Chemaxon logS -1.3 ALOGPS pKa (Strongest Acidic) 2.24 Chemaxon pKa (Strongest Basic) 9.41 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 63.32 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 41.1 m3·mol-1 Chemaxon Polarizability 17.52 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
- Not Available
- Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 128.85841 predictedDeepCCS 1.0 (2019) [M+H]+ 131.49936 predictedDeepCCS 1.0 (2019) [M+Na]+ 140.03334 predictedDeepCCS 1.0 (2019)
Drug created at June 23, 2017 20:38 / Updated at June 12, 2020 16:53