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CHEBI:754956 - ispinesib mesylate

Default Structure
ChEBI IDCHEBI:754956
ChEBI Nameispinesib mesylate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaCH4O3S.C30H33ClN4O2
Net Charge0
Average Mass613.180
Monoisotopic Mass612.21732
SMILESCS(=O)(=O)O.Cc1ccc(C(=O)N(CCCN)[C@@H](c2nc3cc(Cl)ccc3c(=O)n2Cc2ccccc2)C(C)C)cc1
InChIInChI=1S/C30H33ClN4O2.CH4O3S/c1-20(2)27(34(17-7-16-32)29(36)23-12-10-21(3)11-13-23)28-33-26-18-24(31)14-15-25(26)30(37)35(28)19-22-8-5-4-6-9-22;1-5(2,3)4/h4-6,8-15,18,20,27H,7,16-17,19,32H2,1-3H3;1H3,(H,2,3,4)/t27-;/m1./s1
InChIKeyMRKSDPIHUJSKRA-HZPIKELBSA-N
ChEBI Ontology
Outgoing Relation(s)
ispinesib mesylate (CHEBI:754956) is a benzamides (CHEBI:22702)
Synonyms  Source
CK-0238273ChEMBL
CK0238273ChEMBL
Ispinesib mesilateChEMBL
Ispinesib mesylateChEMBL
SB-715992-SChEMBL
Citations