MedKooCat#:402502
Name:Indotecan
CAS#:915303-09-2
ChemicalFormula:C26H26N2O7
ExactMass:478.174
MolecularWeight:478.49
ElementalAnalysis:C,65.26;H,5.48;N,5.85;O,23.41
Synonym:LMP400;LMP-400;LMP400;Indotecan.
IUPAC/ChemicalName:2,3-dimethoxy-6-(3-morpholinopropyl)-5H-[1,3]dioxolo[4",5":5,6]indeno[1,2-c]isoquinoline-5,12(6H)-dione
InChiKey:FMFIFGLHVOZDEL-UHFFFAOYSA-N
InChiCode:InChI=1S/C26H26N2O7/c1-31-19-10-15-18(13-20(19)32-2)26(30)28(5-3-4-27-6-8-33-9-7-27)24-16-11-21-22(35-14-34-21)12-17(16)25(29)23(15)24/h10-13H,3-9,14H2,1-2H3
SMILESCode:O=C1N(CCCN2CCOCC2)C3=C(C(C4=C3C=C(OCO5)C5=C4)=O)C6=C1C=C(OC)C(OC)=C6
TechnicalData
AdditionalInformation
References
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2:BeckDE,AgamaK,MarchandC,CherguiA,PommierY,CushmanM.SynthesisandBIOLOGicalevaluationofnewcarbohydrate-substitutedindenoisoquinolinetopoisomeraseIinhibitorsandimprovedsynthesesoftheexperimentalanticanceragentsindotecan(LMP400)andindimitecan(LMP776).JMedChem.2014Feb27;57(4):1495-512.doi:10.1021/jm401814y.Epub2014Feb11.PubMedPMID:24517248;PubMedCentralPMCID:PMC3983348.
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4:CinelliMA,ReddyPV,LvPC,LiangJH,ChenL,AgamaK,PommierY,vanBreemenRB,CushmanM.Identification,synthesis,andbiologicalevaluationofmetabolitesoftheexperimentalcancertreatmentdrugsindotecan(LMP400)andindimitecan(LMP776)andinvestigationofisomericallyhydroxylatedindenoisoquinolineanaloguesastopoisomeraseIpoisons.JMedChem.2012Dec27;55(24):10844-62.doi:10.1021/jm300519w.Epub2012Dec7.PubMedPMID:23215354;PubMedCentralPMCID:PMC3542640.
5:Balaña-FouceR,PradaCF,RequenaJM,CushmanM,PommierY,Ã
