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03. Biological Effects of Specific Chemicals
03. Biological Effects of Specific Chemicals
imatinib methanesulfonate [CHEBI:31690] (1)
imatinib methanesulfonate [CHEBI:31690] (1)
05. Industrial Uses
05. Industrial Uses
imatinib methanesulfonate [CHEBI:31690] (1)
08. Chemical Category
08. Chemical Category
imatinib methanesulfonate [CHEBI:31690] (1)
imatinib methanesulfonate [CHEBI:31690] (1)
imatinib methanesulfonate [CHEBI:31690] (1)
imatinib methanesulfonate [CHEBI:31690] (1)
ChEBI Compound Accession Identifier :
[CHEBI:31690]
ChEBI Compound Description :
A methanesulfonate (mesylate) salt that is the monomesylate salt of imatinib. Used for treatment of chronic myelogenous leukemia and gastrointestinal stromal tumours.
ChEBI Compound Identification Number :
31690
ChEBI InChI Value :
"InChI=1S/C29H31N7O.CH4O3S/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36;1-5(2,3)4/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34);1H3,(H,2,3,4)"
ChEBI InChIKey Value :
YLMAHDNUQAMNNX-UHFFFAOYSA-N
ChEBI Compound Name :
imatinib methanesulfonate
ChEBI SMILES Value :
CS(O)(=O)=O.CN1CCN(CC1)Cc1ccc(cc1)C(=O)Nc1ccc(C)c(Nc2nccc(n2)-c2cccnc2)c1
ChEBI Substance ID :
46530584
ChEBI URL :
ChEBI:31690
ChemSpider ID :
110189
Ontomatica Chemical Accession Key (OnChAKey) :
YLMAHDNUQAMNNX_UHFFFAOYSA_N_000_000000
PubChem Compound ID :
123596