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Cis, trans-Germacrone

CAT: 0013-GTR19212785-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19212785-02Size:50 mg
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Description
Cis, trans-Germacrone, an isomer of germacrone, exhibits broad antitumor, antioxidant, and anti-inflammatory activities. It inhibits lung cancer cell proliferation by modulating the Akt/MDM2/p53 pathway and inducing G1/S phase cell cycle arrest, supporting its use in cancer research both in vitro and in vivo.
CAS Number
32663-51-7
Field of Research
Cell Biology, Signal Transduction
Smiles
O=C1C/C (C) =C\CC/C (C) =C/C/C1=C (C) /C
Molecular Formula
C15H22O
Molecular Weight
218.33
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-, (Z,E)-

3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-, (Z,E)- has been reported in Curcuma xanthorrhiza, Rhododendron edgeworthii, and other organisms with data available.

CAS Number32663-51-7
PubChem CID81323
IUPAC Name3,7-dimethyl-10-propan-2-ylidenecyclodeca-3,7-dien-1-one
Molecular FormulaC15H22O
Molecular Weight218.33
XLogP3.5
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count16
Formal Charge0
Complexity363
SMILES
CC1=CCC(=C(C)C)C(=O)CC(=CCC1)C
InChI
InChI=1S/C15H22O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h7-8H,5-6,9-10H2,1-4H3
InChIKey
CAULGCQHVOVVRN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-, (Z,E)-
CAS: 32663-51-7
CID: 81323
Formula: C15H22O
MW: 218.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight218.33
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass218.167065321
Monoisotopic Mass218.167065321
Topological Polar Surface Area17.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity363
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count2
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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