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CHEBI:232861 - VTP-50469

ChEBI IDCHEBI:232861
ChEBI NameVTP-50469
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC32H47FN6O4S
Net Charge0
Average Mass630.831
Monoisotopic Mass630.33635
SMILESCC(C)N(C(=O)c1cc(F)ccc1Oc1cncnc1N1CC2(CCN(CC3CCC(NS(C)(=O)=O)CC3)CC2)C1)C(C)C
InChIInChI=1S/C32H47FN6O4S/c1-22(2)39(23(3)4)31(40)27-16-25(33)8-11-28(27)43-29-17-34-21-35-30(29)38-19-32(20-38)12-14-37(15-13-32)18-24-6-9-26(10-7-24)36-44(5,41)42/h8,11,16-17,21-24,26,36H,6-7,9-10,12-15,18-20H2,1-5H3
InChIKeyADHHOUXZPBYYSU-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
VTP-50469 (CHEBI:232861) has role antineoplastic agent (CHEBI:35610)
VTP-50469 (CHEBI:232861) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
5-fluoro-2-[4-[7-[[4-(methanesulfonamido)cyclohexyl]methyl]-2,7-diazaspiro[3.5]nonan-2-yl]pyrimidin-5-yl]oxy-N,N-di(propan-2-yl)benzamide
Citations