CHEBI:177746 - Golvatinib

ChEBI IDCHEBI:177746
ChEBI NameGolvatinib
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H37F2N7O4
Net Charge0
Average Mass633.700
Monoisotopic Mass633.28751
SMILESCN1CCN(C2CCN(C(=O)Nc3cc(Oc4ccc(NC(=O)C5(C(=O)Nc6ccc(F)cc6)CC5)c(F)c4)ccn3)CC2)CC1
InChIInChI=1S/C33H37F2N7O4/c1-40-16-18-41(19-17-40)24-9-14-42(15-10-24)32(45)39-29-21-26(8-13-36-29)46-25-6-7-28(27(35)20-25)38-31(44)33(11-12-33)30(43)37-23-4-2-22(34)3-5-23/h2-8,13,20-21,24H,9-12,14-19H2,1H3,(H,37,43)(H,38,44)(H,36,39,45)
InChIKeyUQRCJCNVNUFYDX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Golvatinib (CHEBI:177746) is a aromatic ether (CHEBI:35618)
IUPAC Name 
1-N'-[2-luoro-4-[2-[[4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl]amino]pyridin-4-yl]oxyphenyl]-1-N-(4-luorophenyl)cyclopropane-1,1-dicarboxamide
Manual XrefsDatabases
17275597ChemSpider
GV0PDBeChem
D10224KEGG DRUG
DB11977DrugBank
LSM-45804LINCS
Registry NumbersSources
CAS:928037-13-2ChemIDplus