Germacrone

Chemical Information
(E,E)-germacrone is a germacrane sesquiterpenoid that has formula C15H22O. It is a natural product found in traditional medicinal plants of the family Zingiberaceae. The compound exhibits a range of pharmacological activities including anti-inflammatory, anticancer, antiviral, anti-androgenic, antioxidant, antimicrobial, antifungal, neuroprotective and insecticidal activities. It has a role as an autophagy inducer, an antifeedant, an antioxidant, an antiviral agent, an insecticide, a volatile oil component, an antimicrobial agent, an androgen antagonist, an antineoplastic agent, an antifungal agent, an antitussive, a hepatoprotective agent, a neuroprotective agent, an anti-inflammatory agent, an apoptosis inducer and a plant metabolite. It is a germacrane sesquiterpenoid and an olefinic compound.
| CAS Number | 6902-91-6 |
| PubChem CID | 6436348 |
| IUPAC Name | (3E,7E)-3,7-dimethyl-10-propan-2-ylidenecyclodeca-3,7-dien-1-one |
| Molecular Formula | C15H22O |
| Molecular Weight | 218.33 |
| XLogP | 3.5 |
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 363 |
| Property | Value |
|---|---|
| Molecular Weight | 218.33 |
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 218.167065321 |
| Monoisotopic Mass | 218.167065321 |
| Topological Polar Surface Area | 17.1 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 363 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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