CHEBI:81707 - Mafoprazine mesylate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Mafoprazine mesylate
ChEBI ID CHEBI:81707
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H32FN3O6S
Net Charge 0
Average Mass 497.58000
Monoisotopic Mass 497.19959
InChI InChI=1S/C22H28FN3O3.CH4O3S/c1-17(27)24-18-8-9-21(22(16-18)28-2)29-15-5-10-25-11-13-26(14-12-25)20-7-4-3-6-19(20)23;1-5(2,3)4/h3-4,6-9,16H,5,10-15H2,1-2H3,(H,24,27);1H3,(H,2,3,4)
InChIKey SEUMNMFHYBUUEX-UHFFFAOYSA-N
SMILES CS(O)(=O)=O.COc1cc(NC(C)=O)ccc1OCCCN1CCN(CC1)c1ccccc1F
ChEBI Ontology
Outgoing Mafoprazine mesylate (CHEBI:81707) is a organic molecular entity (CHEBI:50860)
Manual Xref Database
C18361 KEGG COMPOUND
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