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CHEBI:230501 - TMP269

Default Structure
ChEBI IDCHEBI:230501
ChEBI NameTMP269
Stars
DefinitionTMP269 is a novel and selective class IIa histone deacetylase (HDAC) inhibitor.
Submitterdelphine
DownloadsMolfile
FormulaC25H21F3N4O3S
Net Charge0
Average Mass514.529
Monoisotopic Mass514.12865
SMILESO=C(NCC1(c2nc(-c3ccccc3)cs2)CCOCC1)c1cccc(-c2noc(C(F)(F)F)n2)c1
InChIInChI=1S/C25H21F3N4O3S/c26-25(27,28)22-31-20(32-35-22)17-7-4-8-18(13-17)21(33)29-15-24(9-11-34-12-10-24)23-30-19(14-36-23)16-5-2-1-3-6-16/h1-8,13-14H,9-12,15H2,(H,29,33)
InChIKeyHORXBWNTEDOVKN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
TMP269 (CHEBI:230501) is a organic molecular entity (CHEBI:50860)
Registry NumbersSources
CAS:1314890-29-3SUBMITTER