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CHEBI:232399 - BIX-01294 trihydrochloride

ChEBI IDCHEBI:232399
ChEBI NameBIX-01294 trihydrochloride
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FormulaC28H38N6O2.3HCl
Net Charge0
Average Mass600.035
Monoisotopic Mass598.23566
SMILESCOc1cc2nc(N3CCCN(C)CC3)n/c(=N\C3CCN(Cc4ccccc4)CC3)c2cc1OC.Cl.Cl.Cl
InChIInChI=1S/C28H38N6O2.3ClH/c1-32-12-7-13-34(17-16-32)28-30-24-19-26(36-3)25(35-2)18-23(24)27(31-28)29-22-10-14-33(15-11-22)20-21-8-5-4-6-9-21;;;/h4-6,8-9,18-19,22H,7,10-17,20H2,1-3H3,(H,29,30,31);3*1H
InChIKeyFMURUEPQXKJIPS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
BIX-01294 trihydrochloride (CHEBI:232399) is a EC 2.1.1.* (methyltransferases) inhibitor (CHEBI:76871)
Synonym  Source
BIX 01294 trihydrochlorideSUBMITTER
Registry NumbersSources
CAS:1392399-03-9SUBMITTER