Products 100286-90-6

CAS 100286-90-6 appears in our catalog under these names: Irinotecan hydrochloride, 95%, Irinotecan HCl, Irinotecan Hydrochloride/ 99.93% (existing batch purity), Irinotecan hydrochloride , Irinotecan hydrochloride anhydrous. Offered by: Combi-blocks, Chemat Brand, TargetMol, Thermo Scientific (Alfa Aesar), Biosynth. Available pack sizes: 5g, 1g, 250mg, on request, 10mg, 25mg, 50mg, 100mg.

Structural formula: {0} (CAS {1})

Irinotecan hydrochloride (anhydrous) is a hydrochloride obtained by combining irinotecan with one molar equivalent of hydrochloric acid. Used (in the form of its trihydrate) in combination with fluorouracil and leucovorin, for the treatment of patients with metastatic adenocarcinoma of the pancreas after disease progression following gemcitabine-based therapy. It is converted via hydrolysis of the carbamate linkage to its active metabolite, SN-38, which is ~1000 times more active. It has a role as an antineoplastic agent, a prodrug, an EC 5.99.1.2 (DNA topoisomerase) inhibitor and an apoptosis inducer. It contains an irinotecan(1+).

Source: ChEBI

Identity
Molecular formulaC33H39ClN4O6
Molecular weight623.1 g/mol
IUPAC name[(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),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;hydrochloride
InChIKeyGURKHSYORGJETM-WAQYZQTGSA-N
SMILESCCC1=C2CN3C(=CC4=C(C3=O)COC(=O)[C@@]4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7.Cl

Computed by PubChem (NCBI)