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CHEBI:63452 - midostaurin

ChEBI IDCHEBI:63452
ChEBI Namemidostaurin
Stars
DefinitionAn organic heterooctacyclic compound that is the N-benzoyl derivative of staurosporine.
Last Modified24 February 2016
SubmitterBijay
DownloadsMolfile
FormulaC35H30N4O4
Net Charge0
Average Mass570.649
Monoisotopic Mass570.22671
SMILESCO[C@@H]1[C@H](N(C)C(=O)c2ccccc2)C[C@H]2O[C@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4
InChIInChI=1S/C35H30N4O4/c1-35-32(42-3)25(37(2)34(41)19-11-5-4-6-12-19)17-26(43-35)38-23-15-9-7-13-20(23)28-29-22(18-36-33(29)40)27-21-14-8-10-16-24(21)39(35)31(27)30(28)38/h4-16,25-26,32H,17-18H2,1-3H3,(H,36,40)/t25-,26-,32-,35+/m1/s1
InChIKeyBMGQWWVMWDBQGC-IIFHNQTCSA-N
Wikipedia
Roles Classification
Biological Role:
EC 2.7.11.13 (protein kinase C) inhibitor  An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of protein kinase C (EC 2.7.11.13).
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
midostaurin (CHEBI:63452) has functional parent staurosporine (CHEBI:15738)
midostaurin (CHEBI:63452) has role antineoplastic agent (CHEBI:35610)
midostaurin (CHEBI:63452) has role EC 2.7.11.13 (protein kinase C) inhibitor (CHEBI:37700)
midostaurin (CHEBI:63452) is a benzamides (CHEBI:22702)
midostaurin (CHEBI:63452) is a indolocarbazole (CHEBI:51915)
midostaurin (CHEBI:63452) is a organic heterooctacyclic compound (CHEBI:38165)
midostaurin (CHEBI:63452) is a γ-lactam (CHEBI:74222)
IUPAC Name 
N-[(5S,6R,7R,9R)-6-methoxy-5-methyl-14-oxo-6,7,8,9,15,16-hexahydro-5H,14H-5,9-epoxy-4b,9a,15-triazadibenzo[b,h]cyclonona[1,2,3,4-jkl]cyclopenta[e]-as-indacen-7-yl]-N-methylbenzamide
INN  Source
midostaurinChemIDplus
Synonyms  Source
CGP 41251ChemIDplus
CGP-41251ChemIDplus
4'-N-benzoylstaurosporineChemIDplus
PKC 412ChemIDplus
PKC412ChemIDplus
benzoylstaurosporineChemIDplus
Manual XrefsDatabases
MidostaurinWikipedia
D05029KEGG DRUG
LSM-2287LINCS
Registry NumbersSources
Reaxys:7345336Reaxys
CAS:120685-11-2ChemIDplus
Citations