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Alloimperatorin

CAT: 0013-GTR19155095-02Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155095-02Size:200 mg
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Description
Alloimperatorin exhibits in vitro antitumor activity in HL-60 acute myeloid leukemia cancer cells via inducing apoptosis, cell cycle disruption and inhibition of cell migration. It photosensitizes efficiently the hemolysis of erythrocytes.
CAS Number
642-05-7
Product Name Alternative
Prangenidin
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 83.33 mg/mL (308.31 mM)
Smiles
CC (C) =CCc (c1c2occ1) c (C=CC (O1) =O) c1c2O
Molecular Formula
C16H14O4
Molecular Weight
270.28
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Alloimperatorin

Alloimperatorin is a member of psoralens.

CAS Number642-05-7
PubChem CID69502
IUPAC Name9-hydroxy-4-(3-methylbut-2-enyl)furo[3,2-g]chromen-7-one
Molecular FormulaC16H14O4
Molecular Weight270.28
XLogP3.9
Topological Polar Surface Area59.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity449
SMILES
CC(=CCC1=C2C=CC(=O)OC2=C(C3=C1C=CO3)O)C
InChI
InChI=1S/C16H14O4/c1-9(2)3-4-10-11-5-6-13(17)20-16(11)14(18)15-12(10)7-8-19-15/h3,5-8,18H,4H2,1-2H3
InChIKey
KDXVVZMYSLWJMA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Alloimperatorin
CAS: 642-05-7
CID: 69502
Formula: C16H14O4
MW: 270.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight270.28
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass270.08920892
Monoisotopic Mass270.08920892
Topological Polar Surface Area59.7 Ų
Heavy Atom Count20
Formal Charge0
Complexity449
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
AB1990Alloimperatorin

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