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Mitoxantrone

CAT: 1410-M18958-05Size: 200 mgDry Ice: NoHazardous: No
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CAT#:1410-M18958-05Size:200 mg
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Description
Mitoxantrone is an anthracenedione antibiotic with antineoplastic activity. Mitoxantrone intercalates into and crosslinks DNA, thereby disrupting DNA and RNA replication.
CAS Number
65271-80-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
444.48
Molecular Formula
C22H28N4O6
Notes
Research use only, not for human use.
Receptor
Topo II

Chemical Information

Mitoxantrone

Mitoxantrone is a dihydroxyanthraquinone that is 1,4-dihydroxy-9,10-anthraquinone which is substituted by 6-hydroxy-1,4-diazahexyl groups at positions 5 and 8. It has a role as an analgesic and an antineoplastic agent.

CAS Number65271-80-9
PubChem CID4212
IUPAC Name1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione
Molecular FormulaC22H28N4O6
Molecular Weight444.5
XLogP1
Topological Polar Surface Area163
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count10
Rotatable Bond Count12
Heavy Atom Count32
Formal Charge0
Complexity571
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
InChIKey
KKZJGLLVHKMTCM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mitoxantrone
CAS: 65271-80-9
CID: 4212
Formula: C22H28N4O6
MW: 444.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight444.5
XLogP31
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count10
Rotatable Bond Count12
Exact Mass444.20088463
Monoisotopic Mass444.20088463
Topological Polar Surface Area163 Ų
Heavy Atom Count32
Formal Charge0
Complexity571
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
FD26022-01Mitoxantrone

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