Mitoxantrone dihydrochloride, Type II topoisomerase inhibitor

Key facts

CAS number

70476-82-3

Purity

>98%

Form

Solid

form

Molecular weight

517.4 Da

Molecular formula

C₂₂H₃₀Cl₂N₄O₆

PubChem

51082

Nature

Synthetic

Solubility

pH 9 Borate buffer < 1 (mg/mL)

Soluble in DMSO to 100 mM

Soluble in water to 10 mM

Biochemical name

Mitoxantrone hydrochloride

Biological description

Type II topoisomerase inhibitor (IC₅₀ = 50 nM). Able to inhibit DNA and protein synthesis, and induce both DNA strand breakage and cross linkage. Antineoplastic, immunomodulatory and chemotherapeutic action.

Canonical smiles

C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO.Cl.Cl

InChi

InChI=1S/C22H28N4O6.2ClH/c27-11-9-23-5-7-25-13-1-2-14(26-8-6-24-10-12-28)18-17(13)21(31)19-15(29)3-4-16(30)20(19)22(18)32;;/h1-4,23-30H,5-12H2;2*1H

InChiKey

ZAHQPTJLOCWVPG-UHFFFAOYSA-N

IUPAC Name

1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione;dihydrochloride