Results for:
PubChem ID: 5281520

(1E,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene

Mass-Spectra

Compound Details

Synonymous names	ALPHA-CARYOPHYLLENE Humulene FAMPSKZZVDUYOS-HRGUGZIWSA-N alpha-Humulene alpha-Humalene AC1NQYKM alpha-Humulene, analytical standard .alpha.-Caryophyllene .alpha.-Humulene 6292AF 54W56MD2WD CHEMBL251280 UNII-54W56MD2WD CHEBI:5768 C09684 OR325391 OR031368 LS-58866 DTXSID30858793 ZINC30726967 3,7,10-Humulatriene MFCD00042689 AKOS015965488 BRN 3240075 FT-0622161 LMPR0103110001 (1E,4E,8E)-alpha-humulene 6753-98-6 EINECS 229-816-7 65907-25-7 19132-75-3 alpha-Humulene, >=96.0% (GC) 2,6,6,9-Tetramethyl-1,4,8-cycloundecatriene 2,6,6,9-tetramethyl-cycloundeca-1,4,8-triene trans,trans,trans-2,6,6,9-Tetramethyl-1,4,8-cycloundecatriene 4-05-00-01171 (Beilstein Handbook Reference) (E,E,E)-2,6,6,9-tetramethyl-1,4,8-cycloundecatriene (1E,4E,8E)-humula-1(11),4,8-triene 2,6,6,9-Tetramethyl-1,4,8-cycloundecatriene (E,E,E)- (1E,4E,8E)-2,6,6,9-tetramethyl-1,4,8-cycloundecatriene (1E,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene 1,4,8-Cycloundecatriene, 2,6,6,9-tetramethyl-, (E,E,E)- Cycloundeca-1,4,8-triene,2,6,6,9-tetramethyl-, (E,E,E)- 2,6,6,9-Tetramethyl-1,4,8-cycloundecatriene-, (1E,4E,8E)- 1,4,8-Cycloundecatriene, 2,6,6,9-tetramethyl-, (1E,4E,8E)-
Microorganism:	Yes
IUPAC name	(1E,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene
SMILES	CC1=CCC(C=CCC(=CCC1)C)(C)C
Inchi	InChI=1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6+,13-7+,14-10+
Formula	C15H24
PubChem ID	5281520
Molweight	204.357
LogP	4.88
Atoms	39
Bonds	39
H-bond Acceptor	0
H-bond Donor	0
Chemical Classification	Terpenes sesquiterpene

mVOC Specific Details

MS-Links

MS-MS Spectrum 110246 MS-MS Spectrum 177872 MS-MS Spectrum 110245 MS-MS Spectrum 177870 MS-MS Spectrum 177871 MS-MS Spectrum 110244

Microorganisms emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Fungi Hypoxylon Antochroum Blaci na endophytic in Bursera lancifolia Ulloa-Benítez et al., 2016 Fungi Fusarium Oxysporum MSA 35 the results led us to propose a possible new direct long-distance mechanism of action for WT antagonistic F. oxysporum that is mediated by vocs Minerdi et al., 2009 Fungi Phoma Sp. n/a Strobel et al., 2014 Fungi Armillaria Mellea n/a Mueller et al., 2013 Fungi Laccaria Bicolor n/a Mueller et al., 2013 Fungi Paxillus Involutus MAJ n/a Mueller et al., 2013 Fungi Paxillus Involutus NAU n/a Mueller et al., 2013 Fungi Pholiota Squarrosa n/a Mueller et al., 2013 Fungi Fusarium Oxysporum MSA 35 long-distance antagonistic action Minerdi et al. 2009 Fungi Antrodia Cinnamomea ATCC 200183 na na Lu et al., 2014

Method

Kingdom Species Growth Medium Applied Method Verification Fungi Hypoxylon Antochroum Blaci PDA/WA + 500 mg l^-1 Chloramphenicol SPME-GC/MS No Fungi Fusarium Oxysporum MSA 35 complete medium (CM) SPME/GC-MS Fungi Phoma Sp. n/a Solid phase microextraction (SPME) Fungi Armillaria Mellea Melin-Nor krans synthetic medium (modified) Headspace trapping ( using stir bar sorptive extraction )/ GC-MS Fungi Laccaria Bicolor Melin-Nor krans synthetic medium (modified) Headspace trapping ( using stir bar sorptive extraction )/ GC-MS Fungi Paxillus Involutus MAJ Melin-Nor krans synthetic medium (modified) Headspace trapping ( using stir bar sorptive extraction )/ GC-MS Fungi Paxillus Involutus NAU Melin-Nor krans synthetic medium (modified) Headspace trapping ( using stir bar sorptive extraction )/ GC-MS Fungi Pholiota Squarrosa Melin-Nor krans synthetic medium (modified) Headspace trapping ( using stir bar sorptive extraction )/ GC-MS Fungi Fusarium Oxysporum MSA 35 PDA/CM CAR/PDMS GCMS yes Fungi Antrodia Cinnamomea ATCC 200183 PDA GC/MS Yes