(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-7-yl [1,4'-bipiperidine]-1'-carboxylate hydrochloride



Compound number:
MolPort-003-666-755
CAS number: 100286-90-6; 136572-09-3
IUPAC:
(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-7-yl [1,4'-bipiperidine]-1'-carboxylate hydrochloride
IUPAC traditional:
irinotecan hydrochloride
SMILES:
Cl.CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12 |r|
InChI key:
GURKHSYORGJETM-WAQYZQTGSA-N
Molecular formula:
C33H39ClN4O6
Molecular weight: 623.15
Solubility: not available

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More Information

Compound Identifiers
Compound number: MolPort-003-666-755
CAS number: 100286-90-6; 136572-09-3

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000001612996
MFCD01862255
[1,4'-bipiperidine]-1'-carboxylic acid, (4S)-4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl ester, monohydrochloride
[1,4'-Bipiperidine]-1'-carboxylic acid,(4S)-4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl ester, monohydrochloride
(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-7-yl 4-(piperidin-1-yl)piperidine-1-carboxylate hyd rochloride
Camptosar
CPT-11 hydrochlorideCamptothecin 11 hydrochloride
Irinotecan
Irinotecan, HCl
Irinotecan HCl
Irinotecan HCL Trihydrate
Irinotecan hydrochloride
Irinotecan hydrochloride (CPT-11)
Irinotecan (hydrochloride hydrate)
irinotecan hydrochloride trihydrate
IrinotecanHClTrihydrate

InChI
InChI: 1S/C33H38N4O6.ClH/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/t33-;/m0./s1
InChI key: GURKHSYORGJETM-WAQYZQTGSA-N

Calculated Properties
Molecular formula: C33H39ClN4O6
Molecular weight: 623.15

Other

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