General Information of Drug (ID: DR5313)
Drug Name
Tecfidera
Prodrug Info Tecfidera is the prodrug of Monomethyl fumarate
Synonyms DIMETHYL FUMARATE
Indication Multiple sclerosis [ICD11: 8A40] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 144.12 Topological Polar Surface Area 52.6
Heavy Atom Count 10 Rotatable Bond Count 4
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4
Cross-matching ID
PubChem CID
637568
ChEBI ID
CHEBI:76004
CAS Number
624-49-7
TTD Drug ID
D0A7MY
Formula
C6H8O4
Canonical SMILES
COC(=O)/C=C/C(=O)OC
InChI
InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+
InChIKey
LDCRTTXIJACKKU-ONEGZZNKSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
Monomethyl fumarate DM015452
5369209
Unclear - Unclear 1 [2] , [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR010909 Tecfidera Monomethyl fumarate Unclear - Unclear ES [2], [3]
References
1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 7045).
2 Dimethyl fumarate alleviates the nitroglycerin (NTG)-induced migraine in mice
3 Dimethyl fumarate: A review of preclinical efficacy in models of neurodegenerative diseases

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