Basic information
- Standard SMILES
O=S(=O)([O-])CCS- InChIKey
ZNEWHQLOPFWXOF-UHFFFAOYSA-M- Molecular formula
- C2H5O3S2-
- Average molar mass
- 141.19 g/mol
Overview
Coenzyme M(1-) is an organosulfonate oxoanion that is the conjugate base of coenzyme M; major species at pH 7.3. It is a conjugate base of a coenzyme M.
Names & identifiers
- Preferred name
- 2-Mercaptoethanesulfonate
- IUPAC
- 2-sulfanylethanesulfonate
Names & synonyms
2-mercaptoethanesulfonateRefChem:9099852-sulfanylethanesulfonatecoenzyme M(1-)coenzyme M anionH-S-CoMCHEBI:58319BBL033929BDBM50247978AKOS025248140NCGC00178318-01NCGC00178318-02
Show more names
NCGC00178318-08PD013089SBI-0051698.P002AB00053617_07AB00053617_08Q579229
Database identifiers
- PubChem CID
- 4077
- ChEBI
CHEBI:58319- Nikkaji
- J1.892.070K
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- -1
- Complexity
- 105
Experimental & physicochemical properties
Human DrugsBreast Feeding; Lactation; Milk, Human; Protective Agents
Safety & regulation
Toxicology
Effects During Pregnancy and Lactation◉ Summary of Use during Lactation
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationSynthetic or natural substances which are given to prevent a disease or disorder or are used in the process of treating a disease or injury due to a poisonous agent.
Related reactions
6 records
Linked notes
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