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CHEBI:747954 - penclomedine

Default Structure
ChEBI IDCHEBI:747954
ChEBI Namepenclomedine
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC8H6Cl5NO2
Net Charge0
Average Mass325.406
Monoisotopic Mass322.88412
SMILESCOc1nc(C(Cl)(Cl)Cl)c(Cl)c(OC)c1Cl
InChIInChI=1S/C8H6Cl5NO2/c1-15-5-3(9)6(8(11,12)13)14-7(16-2)4(5)10/h1-2H3
InChIKeyDZVPGIORVGSQMC-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
penclomedine (CHEBI:747954) has role antineoplastic agent (CHEBI:35610)
penclomedine (CHEBI:747954) is a chloropyridine (CHEBI:39173)
Synonyms  Source
NSC-338720ChEMBL
PenclomedineChEMBL
Citations