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Miltirone

CAT: 0013-GTR19156945-04Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19156945-04Size:1 g
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Description
Miltirone is a CYPs inhibitor, it has been characterized as a low-affinity ligand for central benzodiazepine receptors.Miltirone inhibited multidrug-resistant P-glycoprotein (P-gp) -overexpressing CEM/ADR5000 cells better than drug-sensitive CCRF-CEM wild-type cells, a phenomenon termed collateral sensitivity. Flow cytometric analyses revealed that Miltirone induced G2/M arrest and apoptosis. Furthermore, Miltirone stimulated reactive oxygen species (ROS) generation and mitochondrial membrane potential (MMP) disruption, which in turn induced DNA damage and activation of caspases and poly ADP-ribose polymerase (PARP) . Downregulation of CCNB1 (cyclin B1) and CDC2 mRNA and upregulation of CDKN1A (p21) mRNA were in accord with Miltirone-induced G2/M arrest. Moreover, Miltirone decreased cell adherence to fibronectin. Molecular docking revealed that Miltirone bound to the ATP-binding site of IKK-β.
CAS Number
27210-57-7
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 50 mg/mL (177.07 mM)
Smiles
CC (C) C1=Cc2ccc3c (CCCC3 (C) C) c2C (=O) C1=O
Molecular Formula
C19H22O2
Molecular Weight
282.38
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Miltirone

Miltirone is an abietane diterpenoid.

CAS Number27210-57-7
PubChem CID160142
IUPAC Name8,8-dimethyl-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione
Molecular FormulaC19H22O2
Molecular Weight282.4
XLogP4.9
Topological Polar Surface Area34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity498
SMILES
CC(C)C1=CC2=C(C3=C(C=C2)C(CCC3)(C)C)C(=O)C1=O
InChI
InChI=1S/C19H22O2/c1-11(2)14-10-12-7-8-15-13(6-5-9-19(15,3)4)16(12)18(21)17(14)20/h7-8,10-11H,5-6,9H2,1-4H3
InChIKey
FEFAIBOZOKSLJR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Miltirone
CAS: 27210-57-7
CID: 160142
Formula: C19H22O2
MW: 282.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight282.4
XLogP34.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass282.161979940
Monoisotopic Mass282.161979940
Topological Polar Surface Area34.1 Ų
Heavy Atom Count21
Formal Charge0
Complexity498
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

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