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CHEBI:751625 - duoperone fumarate

Default Structure
ChEBI IDCHEBI:751625
ChEBI Nameduoperone fumarate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC4H4O4.C28H26F4N2OS
Net Charge0
Average Mass630.660
Monoisotopic Mass630.18116
SMILESO=C(O)/C=C/C(=O)O.O=C(c1ccc(F)cc1)C1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
InChIInChI=1S/C28H26F4N2OS.C4H4O4/c29-22-9-6-19(7-10-22)27(35)20-12-16-33(17-13-20)14-3-15-34-23-4-1-2-5-25(23)36-26-11-8-21(18-24(26)34)28(30,31)32;5-3(6)1-2-4(7)8/h1-2,4-11,18,20H,3,12-17H2;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKeyYETRXLVOWPGIHR-WLHGVMLRSA-N
ChEBI Ontology
Outgoing Relation(s)
duoperone fumarate (CHEBI:751625) is a phenothiazines (CHEBI:38093)
Synonyms  Source
AHR 6646ChEMBL
AHR-6646ChEMBL
Duoperone fumarateChEMBL
Citations