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CHEBI:752578 - esmirtazapine maleate

Default Structure
ChEBI IDCHEBI:752578
ChEBI Nameesmirtazapine maleate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC4H4O4.C17H19N3
Net Charge0
Average Mass381.432
Monoisotopic Mass381.16886
SMILESO=C(O)/C=C\C(=O)O.[H][C@]12CN(C)CCN1c1ncccc1Cc1ccccc12
InChIInChI=1S/C17H19N3.C4H4O4/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20;5-3(6)1-2-4(7)8/h2-8,16H,9-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t16-;/m1./s1
InChIKeyRPUBHMMISKEXSR-MLCLTIQSSA-N
ChEBI Ontology
Outgoing Relation(s)
esmirtazapine maleate (CHEBI:752578) is a organic heterobicyclic compound (CHEBI:27171)
esmirtazapine maleate (CHEBI:752578) is a organonitrogen heterocyclic compound (CHEBI:38101)
Synonyms  Source
Esmirtazapine maleateChEMBL
Mirtazapine maleate, (s)-ChEMBL
ORG 50081ChEMBL
ORG-50081ChEMBL