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CAS 136572-09-3

:

Irinotecan hydrochloride trihydrate

Description:
Irinotecan hydrochloride trihydrate is a chemotherapeutic agent primarily used in the treatment of colorectal cancer. It is a water-soluble salt derived from the natural alkaloid camptothecin and functions as a topoisomerase I inhibitor, disrupting DNA replication and transcription in cancer cells. The substance appears as a white to off-white crystalline powder and is hygroscopic, meaning it can absorb moisture from the environment. Its molecular formula includes a hydrochloride component and three water molecules, contributing to its stability and solubility in aqueous solutions. Irinotecan is administered intravenously and is often used in combination with other chemotherapeutic agents to enhance efficacy. Common side effects include diarrhea, nausea, and myelosuppression, necessitating careful monitoring during treatment. The compound's pharmacokinetics involve metabolism primarily by the liver, with active metabolites contributing to its therapeutic effects and toxicity. Overall, irinotecan hydrochloride trihydrate plays a significant role in oncology, particularly in managing advanced-stage cancers.
Formula:C33H38N4O6·ClH·3H2O
InChI:InChI=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
InChI key:InChIKey=KLEAIHJJLUAXIQ-JDRGBKBRSA-N
SMILES:C(C)C1=C2C(C=3N(C2)C(=O)C4=C(C3)[C@](CC)(O)C(=O)OC4)=NC=5C1=CC(OC(=O)N6CCC(CC6)N7CCCCC7)=CC5.Cl.O
Synonyms:
  • (+)-7-Ethyl-10-[4-(1-piperidino)-1-piperidino]-carbonyloxycamptothecin, monohydrochloride, trihydrate
  • (+)-7-Ethyl-10-hydroxycamptothecine 10-(1,4'-bipiperidine)-1'-carboxylate, monohydrochloride, trihydrate
  • (1,4'-Bipiperidine)-1'-Carboxylicacid,4,11-Diethyl-3,4,12,14-Tetrahydro-4-Hyd Monohydrochloride, Trihydrate
  • (1,4'-Bipiperidine)-1'-carboxylic acid, 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, trihydrate, (S)-
  • (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 [1,4'-bipiperidine]-1'-carboxylate trihydrate hydrochloride
  • (S)-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 trihydrate
  • (S)-[1,4'-Bipiperidine]-1'-Carboxylic Acid 4,11-Diethyl-3,4,12,14-Tetrahydro-4-Hydroxy-3,14-Dioxo-1H-Pyrano
  • (S)-[1,4'-Bipiperidine]-1'-carboxylic acid 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 hydrochloride trihydrate
  • 1H-Pyrano[3′,4′:6,7]indolizino[1,2-b]quinoline, [1,4′-bipiperidine]-1′-carboxylic acid deriv.
  • Camptosar
  • See more synonyms
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