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irinotecan hydrochloride hydrate

PropertiesImageOccurences in reactions
MNX_IDMNXM126764Image of MNXM126764
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC33H45ClN4O9
charge0
mass676.28751
referencechebi:90881
InChIKeyKLEAIHJJLUAXIQ-JDRGBKBRSA-N
InChIInChI=1S/C33H38N4O6.ClH.3H2O/c1-3-22-23-16-21(43-32(40)36-14-10-20(11-15-36)35-12-6-5-7-13-35)8-9-27(23)34-29-24(22)18-37-28(29)17-26-25(30(37)38)19-42-31(39)33(26,41)4-2;;;;/h8-9,16-17,20,41H,3-7,10-15,18-19H2,1-2H3;1H;3*1H2/t33-;;;;/m0..../s1
SMILESCCc1c2c(nc3ccc(OC(=O)N4CCC(N5CCCCC5)CC4)cc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC.Cl.O.O.O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:90881
chebi:90881 		irinotecan hydrochloride hydrate
(4S)-4,11-diethyl-4-hydroxy-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl [1,4'-bipiperidine]-1'-carboxylate hydrochloride--water (1/3)
1-[1-({[(4S)-4,11-diethyl-4-hydroxy-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl]oxy}carbonyl)piperidin-4-yl]piperidin-1-ium chloride--water (1/3)
CPT 11
CPT-11
Camptosar
Irinotecan hydrochloride
ONIVYDE
U-101,440E
irinotecan hydrochloride trihydrate
irinotecan monohydrochloride trihydrate
kegg.drug:D01061
keggD:D01061 		Irinotecan hydrochloride (USP)
CPT 11
CPT-11
Campto (TN)
Camptosar (TN)
Irinotecan hydrochloride hydrate (JP18)
Irinotecan hydrochloride trihydrate
Onivyde (TN)
keggD:M_D01061 secondary/obsolete/fantasy identifier