Results for:
PubChem ID: 10104370

(4S)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene

Mass-Spectra

Compound Details

Synonymous names
beta-Bisabolene
495-61-4
(S)-beta-bisabolene
(-)-beta-bisabolene
l-beta-Bisabolene
(S)-1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)cyclohexene
.beta.-Bisabolene
(S)-1-Methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohex-1-ene
(-)-.beta.-bisabolene
S19BRC22QA
CHEBI:49263
Cyclohexene, 1-methyl-4-(5-methyl-1-methylene-4-hexenyl)-, (S)-
(4S)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene
(S)-(-)-6-methyl-2-(4-methyl-3-cyclohexen-1-yl)-1,5-heptadiene
6-methyl-2-[(1R)-4-methyl-1-cyclohex-3-enyl]hepta-1,5-diene
1,5-Heptadiene, 6-methyl-2-(4-methyl-3-cyclohexen-1-yl)-, (S)-(-)-
(1S)-bisabola-4,7(11),10(15)-triene (4S)-1-methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene
UNII-S19BRC22QA
??-Bisabolene
l-.beta.-Bisabolene
BISABOLENE [FHFI]
(+,-)-.beta.-Bisabolene
CHEMBL1077088
FEMA NO. 4940
(-)-b-Bisabolene (>85%)
(-)-beta-Bisabolene (>85%)
DTXSID701017550
Cyclohexene, 1-methyl-4-(5-methyl-1-methylene-4-hexenyl)-, (4S)-
AKOS040758160
LMPR0103060013
BS-47085
HY-136552
CS-0131096
(1S)-bisabola-4,7(11),10(15)-triene
F73181
Q11595687
(s)-1-methyl-4-(5-methyl-1-methylene-4-hexenyl)-cyclohexene
1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)-(S)-cyclohexene
(4S)-1-methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene
(4S)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohex-1-ene
1-Methyl-4-(5-methyl-1-methylene-4-hexenyl)-1-cyclohexene-, (4S)-
CYCLOHEXENE, 1-METHYL-4-(5-METHYL-1-METHYLENE-4-HEXENYL-(S)-
CYCLOHEXENE, 1-METHYL-4-(5-METHYL-1-METHYLENE-4-HEXEN-1-YL)-, (4S)-
Microorganism:

Yes

IUPAC name(4S)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene
SMILESCC1=CCC(CC1)C(=C)CCC=C(C)C
InchiInChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,15H,4-5,7,9-11H2,1-3H3/t15-/m1/s1
FormulaC15H24
PubChem ID10104370
Molweight204.35
LogP5.2
Atoms15
Bonds4
H-bond Acceptor0
H-bond Donor0
Chemical Classificationterpenes
CHEBI-ID49263
Supernatural-IDSN0444416-02

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaAspergillus FumigatusNANAHeddergott et al. 2014
EukaryotaAspergillus ClavatusNADickschat et al. 2018
EukaryotaAspergillus FischeriNADickschat et al. 2018
EukaryotaFusarium Oxysporum0NALi et al. 2018
EukaryotaTrichoderma HarzianumNAGuo et al. 2019
EukaryotaTrichoderma HamatumNAGuo et al. 2019
EukaryotaTrichoderma VirensNAGuo et al. 2019
EukaryotaFusarium OxysporumNALi et al. 2018
EukaryotaTrichoderma Asperellumreduce downy mildew severity on Vitis vinifera (grapevine plants)Cotxarrera et al., 2002Lazazzara et al. 2021
EukaryotaTrichoderma Atroviridereduce downy mildew severity on Vitis vinifera (grapevine plants)Pertot et al., 2008Lazazzara et al. 2021
EukaryotaTrichoderma Harzianumreduce downy mildew severity on Vitis vinifera (grapevine plants)Eladet al., 1997Lazazzara et al. 2021
EukaryotaPleurotus CystidiosusnanaUsami et al. 2014
EukaryotaTrichoderma Harzianumn/aNAZhang et al. 2014
EukaryotaTrichoderma AtrovirideNAStoppacher et al. 2010
EukaryotaLaccaria Bicolorn/aNAMueller et al. 2013
EukaryotaPaxillus Involutusn/aNAMueller et al. 2013
EukaryotaArmillaria Mellean/aNAMueller et al. 2013
EukaryotaPholiota Squarrosan/aNAMueller et al. 2013
EukaryotaStropharia Rugosoannulatan/aNAMueller et al. 2013
EukaryotaTrichoderma Viriden/aNAMueller et al. 2013
EukaryotaGanoderma Lucidumnasaprophytic on deciduous treesCampos Ziegenbein et al. 2006
EukaryotaPenicillium Polonicumnawater damaged buildings, BelgiumPolizzi et al. 2012
EukaryotaTrichoderma Atroviridenawater damaged buildings, BelgiumPolizzi et al. 2012
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
Kluyveromyces MarxianusJi et al. 2024
Saccharomyces CerevisiaeJi et al. 2024
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaAspergillus FumigatusBrianSPME/GC-MSno
EukaryotaAspergillus Clavatusmedium 129CLSA-GCMSno
EukaryotaAspergillus Fischerimedium 129CLSA-GCMSno
EukaryotaFusarium OxysporumPDA plateSPME-GC-MSno
EukaryotaTrichoderma HarzianumMelin-Norkrans synthetic mediumSBSE-GC-MSno
EukaryotaTrichoderma HamatumMelin-Norkrans synthetic mediumSBSE-GC-MSno
EukaryotaTrichoderma VirensMelin-Norkrans synthetic mediumSBSE-GC-MSno
EukaryotaFusarium Oxysporumpotato dextrose agarSPME, GC-MSno
EukaryotaTrichoderma AsperellumPDA mediaHS-SPME/GC-MSno
EukaryotaTrichoderma AtroviridePDA mediaHS-SPME/GC-MSno
EukaryotaTrichoderma HarzianumPDA mediaHS-SPME/GC-MSno
EukaryotaPleurotus CystidiosusnaGC/MS, GC-O, AEDAno
EukaryotaTrichoderma HarzianumMinimal mediaSPME/GC-MSno
EukaryotaTrichoderma AtroviridePotato dextrose agarHS-SPME/GC-MS no
EukaryotaLaccaria BicolorMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaPaxillus InvolutusMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaArmillaria MelleaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaPholiota SquarrosaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaStropharia RugosoannulataMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaTrichoderma VirideMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MSno
EukaryotaGanoderma LucidumnaGC/MSno
EukaryotaPenicillium Polonicummalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSno
EukaryotaTrichoderma Atroviridemalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSno
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
Kluyveromyces MarxianusSauce Meat during StorageSPME–GC–MSno
Saccharomyces CerevisiaeSauce Meat during StorageSPME–GC–MSno