6902-91-6,MFCD00210050
Catalog No.:AA00IBTD

6902-91-6 | 3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-,(3E,7E)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98% by HPLC
in stock  
$77.00   $54.00
- +
5mg
98%(HPLC)
in stock  
$80.00   $56.00
- +
25mg
98%(HPLC)
in stock  
$239.00   $167.00
- +
100mg
98%(HPLC)
in stock  
$780.00   $546.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IBTD
Chemical Name:
3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-,(3E,7E)-
CAS Number:
6902-91-6
Molecular Formula:
C15H22O
Molecular Weight:
218.3346
MDL Number:
MFCD00210050
SMILES:
C/C/1=C\CC(=C(C)C)C(=O)C/C(=C/CC1)/C
Properties
Computed Properties
 
Complexity:
363  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
2  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.5  

Downstream Synthesis Route

[1]JournalofOrganicChemistry,2019,vol.84,p.6886-6894

Literature

Title: Germacrone reverses adriamycin resistance in human chronic myelogenous leukemia K562/ADM cells by suppressing MDR1 gene/P-glycoprotein expression.

Journal: Chemico-biological interactions 20180525

Title: Interactions of sesquiterpenes zederone and germacrone with the human cytochrome P450 system.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20130901

Title: Anti-androgenic effect of sesquiterpenes isolated from the rhizomes of Curcuma aeruginosa Roxb.

Journal: Fitoterapia 20120701

Title: Transannular cyclization of (4S,5S)-germacrone-4,5-epoxide into guaiane and secoguaiane-type sesquiterpenes.

Journal: Natural product communications 20120401

Title: Germacrone inhibits the proliferation of breast cancer cell lines by inducing cell cycle arrest and promoting apoptosis.

Journal: European journal of pharmacology 20110930

Title: Efficient synthesis of the anticancer β-elemene and other bioactive elemanes from sustainable germacrone.

Journal: Organic & biomolecular chemistry 20110221

Title: Geranium macrorrhizum L. (Geraniaceae) essential oil: a potent agent against Bacillus subtilis.

Journal: Chemistry & biodiversity 20101101

Title: [Comparison of content of curdione, curcumol, germacrone and beta-elemene in different varieties of vinegar backed Rhizoma Curcuma].

Journal: Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica 20101101

Title: New pathways in transannular cyclization of germacrone [germacra-1(10),4,7(11)-trien-8-one]: evidence regarding a concerted mechanism.

Journal: Organic letters 20091105

Title: [Comparisons of volatile components in different parts of three species of Rhizoma Curcumae].

Journal: Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials 20091001

Title: Sesquiterpenes from Curcuma comosa.

Journal: Journal of natural medicines 20090101

Title: Structural determination of two new sesquiterpenes biotransformed from germacrone by Mucor alternata.

Journal: Magnetic resonance in chemistry : MRC 20080201

Title: Analysis of volatile components of Curcuma sichuanensis X. X. Chen by gas chromatography-mass spectrometry.

Journal: Journal of pharmaceutical and biomedical analysis 20070117

Title: Cytotoxic terpene hydroperoxides from the aerial parts of Aster spathulifolius.

Journal: Archives of pharmacal research 20061001

Title: [The fingerprint of Ezhu by GC-MS].

Journal: Yao xue xue bao = Acta pharmaceutica Sinica 20051101

Title: Identification and quantitation of eleven sesquiterpenes in three species of Curcuma rhizomes by pressurized liquid extraction and gas chromatography-mass spectrometry.

Journal: Journal of pharmaceutical and biomedical analysis 20050915

Title: A HPLC method for the analysis of germacrone in rabbit plasma and its application to a pharmacokinetic study of germacrone after administration of zedoary turmeric oil.

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20050905

Title: Molecular genetic and chemical assessment of Rhizoma Curcumae in China.

Journal: Journal of agricultural and food chemistry 20050727

Title: Preparative isolation and purification of germacrone and curdione from the essential oil of the rhizomes of Curcuma wenyujin by high-speed counter-current chromatography.

Journal: Journal of chromatography. A 20050408

Title: [Absorption of zedoary oil in rat intestine using in situ single pass perfusion model].

Journal: Yao xue xue bao = Acta pharmaceutica Sinica 20041001

Title: Liao Q, et al. Germacrone inhibits early stages of influenza virus infection. Antiviral Res. 2013 Dec;100(3):578-88.

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Tags:6902-91-6 Molecular Formula|6902-91-6 MDL|6902-91-6 SMILES|6902-91-6 3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-,(3E,7E)-
Catalog No.: AA00IBTD
6902-91-6,MFCD00210050
6902-91-6 | 3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-,(3E,7E)-
Pack Size: 1mg
Purity: 98% by HPLC
in stock
$77.00 $54.00
Pack Size: 5mg
Purity: 98%(HPLC)
in stock
$80.00 $56.00
Pack Size: 25mg
Purity: 98%(HPLC)
in stock
$239.00 $167.00
Pack Size: 100mg
Purity: 98%(HPLC)
in stock
$780.00 $546.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IBTD
Chemical Name: 3,7-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-,(3E,7E)-
CAS Number: 6902-91-6
Molecular Formula: C15H22O
Molecular Weight: 218.3346
MDL Number: MFCD00210050
SMILES: C/C/1=C\CC(=C(C)C)C(=O)C/C(=C/CC1)/C
Properties
Complexity: 363  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 2  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.5  
Downstream Synthesis Route
6902-91-6    6989-21-5 

[1]JournalofOrganicChemistry,2019,vol.84,p.6886-6894

Literature fold

Title: Germacrone reverses adriamycin resistance in human chronic myelogenous leukemia K562/ADM cells by suppressing MDR1 gene/P-glycoprotein expression.

Journal: Chemico-biological interactions20180525

Title: Interactions of sesquiterpenes zederone and germacrone with the human cytochrome P450 system.

Journal: Toxicology in vitro : an international journal published in association with BIBRA20130901

Title: Anti-androgenic effect of sesquiterpenes isolated from the rhizomes of Curcuma aeruginosa Roxb.

Journal: Fitoterapia20120701

Title: Transannular cyclization of (4S,5S)-germacrone-4,5-epoxide into guaiane and secoguaiane-type sesquiterpenes.

Journal: Natural product communications20120401

Title: Germacrone inhibits the proliferation of breast cancer cell lines by inducing cell cycle arrest and promoting apoptosis.

Journal: European journal of pharmacology20110930

Title: Efficient synthesis of the anticancer β-elemene and other bioactive elemanes from sustainable germacrone.

Journal: Organic & biomolecular chemistry20110221

Title: Geranium macrorrhizum L. (Geraniaceae) essential oil: a potent agent against Bacillus subtilis.

Journal: Chemistry & biodiversity20101101

Title: [Comparison of content of curdione, curcumol, germacrone and beta-elemene in different varieties of vinegar backed Rhizoma Curcuma].

Journal: Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica20101101

Title: New pathways in transannular cyclization of germacrone [germacra-1(10),4,7(11)-trien-8-one]: evidence regarding a concerted mechanism.

Journal: Organic letters20091105

Title: [Comparisons of volatile components in different parts of three species of Rhizoma Curcumae].

Journal: Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials20091001

Title: Sesquiterpenes from Curcuma comosa.

Journal: Journal of natural medicines20090101

Title: Structural determination of two new sesquiterpenes biotransformed from germacrone by Mucor alternata.

Journal: Magnetic resonance in chemistry : MRC20080201

Title: Analysis of volatile components of Curcuma sichuanensis X. X. Chen by gas chromatography-mass spectrometry.

Journal: Journal of pharmaceutical and biomedical analysis20070117

Title: Cytotoxic terpene hydroperoxides from the aerial parts of Aster spathulifolius.

Journal: Archives of pharmacal research20061001

Title: [The fingerprint of Ezhu by GC-MS].

Journal: Yao xue xue bao = Acta pharmaceutica Sinica20051101

Title: Identification and quantitation of eleven sesquiterpenes in three species of Curcuma rhizomes by pressurized liquid extraction and gas chromatography-mass spectrometry.

Journal: Journal of pharmaceutical and biomedical analysis20050915

Title: A HPLC method for the analysis of germacrone in rabbit plasma and its application to a pharmacokinetic study of germacrone after administration of zedoary turmeric oil.

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences20050905

Title: Molecular genetic and chemical assessment of Rhizoma Curcumae in China.

Journal: Journal of agricultural and food chemistry20050727

Title: Preparative isolation and purification of germacrone and curdione from the essential oil of the rhizomes of Curcuma wenyujin by high-speed counter-current chromatography.

Journal: Journal of chromatography. A20050408

Title: [Absorption of zedoary oil in rat intestine using in situ single pass perfusion model].

Journal: Yao xue xue bao = Acta pharmaceutica Sinica20041001

Title: Liao Q, et al. Germacrone inhibits early stages of influenza virus infection. Antiviral Res. 2013 Dec;100(3):578-88.

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