Results for:
PubChem ID: 1549778

(5E)-6,10-dimethylundeca-5,9-dien-2-one

Mass-Spectra

Compound Details

Synonymous names	Geranylacetone Geranyl acetone 3796-70-1 689-67-8 (5E)-6,10-dimethylundeca-5,9-dien-2-one (E)-6,10-Dimethylundeca-5,9-dien-2-one trans-Geranylacetone 5,9-Undecadien-2-one, 6,10-dimethyl- (E)-6,10-Dimethyl-5,9-undecadien-2-one (E)-geranylacetone 6,10-Dimethyl-5,9-undecadien-2-one Dihydropseudoionone 6,10-Dimethylundeca-5,9-dien-2-one FEMA No. 3542 cis,trans-Geranylacetone 5,9-Undecadien-2-one, 6,10-dimethyl-, (E)- 5,9-Undecadien-2-one, 6,10-dimethyl-, (5E)- 9B7RY79U9Z trans-6,10-Dimethyl-5,9-undecadien-2-one 6,10-Dimethyl-5(E),9-undecadien-2-one 6,10-dimethyl-(E)-5,9-undecadien-2-one 6,10-dimethyl-5,9-undecadiene-2-one DTXCID901586 Geranylacetone, trans- .alpha.,.beta.-Dihydropseudoionone Geranylacetone(Z/E) NSC 406679 2,6-dimethylundeca-2,6-dien-10-one 6,10-Dimethyl-undeca-5,9-dien-2-one CAS-689-67-8 (5E)-6,10-dimethyl-2-undeca-5,9-dienone (5E)-6,10-Dimethyl-5,9-undecadien-2-one EINECS 223-269-8 DTXSID1021586 UNII-9B7RY79U9Z E-geranylacetone MFCD00008910 Undecadien-2-one, 6,10-dimethyl- 2,6-Dimethyl-2,6-undecadien-2-one, trans- 6,10-Dimethyl-5,9-undecadien-2-one, trans- E-geranyl acetone 6,10-Dimethyl-5,9-undecadien-2-one, (E)- 68228-05-7 Geranyl-2-propanone (E/Z)-Geranylacetone 97%(total of isomers) 5, 6,10-dimethyl- SCHEMBL112855 SCHEMBL112856 AMY806 DTXSID4052053 CHEBI:67206 HY-N8446 EINECS 269-400-2 Tox21_202156 Tox21_302933 AC1127 BBL027735 LMFA11000696 NSC406679 STK709221 6,10-dimethyl-5,9-undecadien-2-on AKOS005522601 MCULE-9307860172 NSC-406679 NCGC00249179-01 NCGC00256556-01 NCGC00259705-01 (4-Trifluoromethyl-phenyl)-phosphonicacid TS-09793 GERANYLACETONE (MIXTURE OF ISOMERS) (5E)-6,10-dimethyl-5,9-undecen-2-one HY-142037 CS-0144246 CS-0343195 G0236 NS00010772 EN300-125485 A836300 SR-01000526349 SR-01000526349-1 W-104645 6,10-DIMETHYL-5,9-UNDECADIEN-2-ONE [FHFI] Q27135687 6,10-Dimethyl-5,9-undecadien-2-one, >=97%, stabilized, FG Geranylacetone, (E)+(Z), 97%, (Z)-isomer (nerylacetone) ca 45%
Microorganism:	Yes
IUPAC name	(5E)-6,10-dimethylundeca-5,9-dien-2-one
SMILES	CC(=CCCC(=CCCC(=O)C)C)C
Inchi	InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+
Formula	C13H22O
PubChem ID	1549778
Molweight	194.31
LogP	3.7
Atoms	14
Bonds	6
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	terpenes ketones
CHEBI-ID	67206
Supernatural-ID	SN0130809-01

mVOC Specific Details

Massbank-Links

Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008402 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008403

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Bacillus Acidiceler NA Méndez-Bravo et al. 2018 Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Eukaryota Candida Albicans ATCC MYA-2876, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Glabrata ATCC 90030, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Tropicalis ATCC 750, American Type Culture Collection Costa et al. 2020 Prokaryota Arthrobacter Phenanthrenivorans antifungal effect on the growth of Alternaria alternata, Corynespora cassiicola and Stemphylium lycopersici (pathogens of tomato plants) shoots of tomato plants (Elpida F1, Enza Zaden) with symptoms of Gray leaf spot López et al. 2021 Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Eukaryota Trichoderma Viride NA Hung et al. 2013 Prokaryota Streptomyces Sp. na breathing zone of a waste collection worker Wilkins 1996 Prokaryota Streptomyces Sp. n/a NA Dickschat et al. 2005_2 Eukaryota Pleurotus Cystidiosus na na Usami et al. 2014 Prokaryota Myxococcus Xanthus n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacteria-Bacteroides Group n/a NA Schulz and Dickschat 2007 Prokaryota Myxobacterium Sp. n/a NA Dickschat et al. 2004 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Loktanella Sp. n/a NA Dickschat et al. 2005_4 Prokaryota Dinoroseobacter Shibae n/a NA Dickschat et al. 2005_4 Prokaryota Stigmatella Aurantiaca n/a NA Dickschat et al. 2005_5 Prokaryota Burkholderia Ambifaria n/a Burkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical. Groenhagen et al. 2013 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012 Prokaryota Pseudomonas Syringae na phyllosphere of field-grown potato plants Hunziker et al. 2015 Eukaryota Ganoderma Lucidum na saprophytic on deciduous trees Campos Ziegenbein et al. 2006 Eukaryota Spongiporus Leucomallellus na saprophytic mostly on wet, old pines Campos Ziegenbein et al. 2006 Eukaryota Tuber Borchii None T. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b Eukaryota Tuber Melanosporum None T. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al. 2007b Prokaryota Lentilactobacillus Buchneri NA NA Squara et al. 2022 Prokaryota Lacticaseibacillus Paracasei NA NA Squara et al. 2022 Eukaryota Cryptococcus Nemorosus NA NA Ljunggren et al. 2019 Eukaryota Metschnikowia Pulcherrima NA NA Ljunggren et al. 2019 Bacillus Thuringiensis Koilybayeva et al. 2023

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Bacillus Acidiceler LB agar SPME / GS-MS no Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Eukaryota Candida Albicans YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Glabrata YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Tropicalis YGC media HS-SPME/GC-GC-ToFMS no Prokaryota Arthrobacter Phenanthrenivorans TYB media GC-MS no Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Eukaryota Trichoderma Viride Malt extract agar Headspace volatiles collected with colomn/TD-GC-MS yes Prokaryota Streptomyces Sp. Nutrient agar CM3 + 50mg/l actidione GC/MS no Prokaryota Streptomyces Sp. n/a n/a no Eukaryota Pleurotus Cystidiosus na GC/MS, GC-O, AEDA no Prokaryota Myxococcus Xanthus n/a n/a no Prokaryota Cytophaga-Flavobacteria-Bacteroides Group n/a n/a no Prokaryota Myxobacterium Sp. n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Loktanella Sp. n/a n/a no Prokaryota Dinoroseobacter Shibae n/a n/a no Prokaryota Stigmatella Aurantiaca n/a n/a no Prokaryota Burkholderia Ambifaria Luria-Bertani medium, Malt Extract n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no Prokaryota Pseudomonas Syringae LB medium GC/MS yes Eukaryota Ganoderma Lucidum na GC/MS no Eukaryota Spongiporus Leucomallellus na GC/MS no Eukaryota Tuber Borchii None None yes Eukaryota Tuber Melanosporum None None yes Prokaryota Lentilactobacillus Buchneri maize silage HS-SPME coupled with GC-TOF MS no Prokaryota Lacticaseibacillus Paracasei maize silage HS-SPME coupled with GC-TOF MS no Eukaryota Cryptococcus Nemorosus liquid YPD medium GC-MS no Eukaryota Metschnikowia Pulcherrima liquid YPD medium GC-MS no Bacillus Thuringiensis bacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L) GC–MS no