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Mitoxantrone-[d8]

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General Information
Catalog: BLP-004771
CAS: 1189974-82-0
Molecular Formula: C22H20D8N4O6
Molecular Weight: 452.53

Chemical Structure

Description	Mitoxantrone-[d8] is the labelled analogue of Mitoxantrone, which is a type II topoisomerase inhibitor. It is used in the treatment of certain types of cancer, mostly metastatic breast cancer, acute myeloid leukemia, and non-Hodgkin's lymphoma.
Synonyms	Mitoxantrone D8; 1,4-Dihydroxy-5,8-bis[[2-[(2-hydroxyethyl-d4)amino]ethyl]amino]-9,10-anthracenedione; 1,4-Bis[(2-(2-hydroxyethylamino-d4)ethyl)amino]-5,8-dihydroxyanthraquinone; DHAQ-d8; Dihydroxyanthraquinone-d8; Mitox-d8; Mitoxanthrone-d8; Mitozantrone-d8; Nimitoxantron-d8; Novantrone-d8; Ralenova-d8; NSC 279836-d8
IUPAC Name	1,4-dihydroxy-5,8-bis[2-[(1,1,2,2-tetradeuterio-2-hydroxyethyl)amino]ethylamino]anthracene-9,10-dione
Related CAS	65271-80-9 (unlabelled)
Isomeric SMILES	[2H]C([2H])(C([2H])([2H])O)NCCNC1=C2C(=C(C=C1)NCCNC([2H])([2H])C([2H])([2H])O)C(=O)C3=C(C=CC(=C3C2=O)O)O
Canonical SMILES	C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO
InChI	InChI=1S/C22H28N4O6/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/i9D2,10D2,11D2,12D2
InChI Key	KKZJGLLVHKMTCM-PMCMNDOISA-N
Melting Point	>145°C (dec.)
Purity	96%; ≥98% atom D
Solubility	Soluble in DMSO, Methanol, Water
Appearance	Dark Blue Solid
Storage	Store at -20°C