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Perezone

CAT: 0931-TN10786-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN10786-02Size:50 mg
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CAS Number
3600-95-1
Target
Apoptosis
Related Pathways
Apoptosis
Bioactivity
Perezone is a sesquiterpene benzoquinone found in the roots of Acourtia species. It inhibits the activity of leukemia cell line K-562 and human glioblastoma cells U-251 (IC50: 6.83 μM) . Perezone enhances the expression of caspase3, 8, and 9 genes associated with apoptosis (Apoptosis), and it also exhibits antioxidant and anti-inflammatory properties.
Smiles
[C@H](CCC=C(C)C)(C)C1=C(O)C(=O)C(C)=CC1=O
Molecular Formula
C15H20O3
Molecular Weight
248.32
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Perezone

perezone has been reported in Coreopsis senaria, Acourtia nana, and other organisms with data available.

CAS Number3600-95-1
PubChem CID92964
IUPAC Name3-hydroxy-5-methyl-2-[(2R)-6-methylhept-5-en-2-yl]cyclohexa-2,5-diene-1,4-dione
Molecular FormulaC15H20O3
Molecular Weight248.32
XLogP3.4
Topological Polar Surface Area54.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity460
SMILES
CC1=CC(=O)C(=C(C1=O)O)[C@H](C)CCC=C(C)C
InChI
InChI=1S/C15H20O3/c1-9(2)6-5-7-10(3)13-12(16)8-11(4)14(17)15(13)18/h6,8,10,18H,5,7H2,1-4H3/t10-/m1/s1
InChIKey
JZXORCGMYQZBBQ-SNVBAGLBSA-N
Chemical Structure
2D Structure
2D structure of Perezone
CAS: 3600-95-1
CID: 92964
Formula: C15H20O3
MW: 248.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight248.32
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass248.14124450
Monoisotopic Mass248.14124450
Topological Polar Surface Area54.4 Ų
Heavy Atom Count18
Formal Charge0
Complexity460
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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