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Compound: 5546
Plants: 312
References: 992
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(Z,Z)-alpha-Farnesene
ScientificNameLabel
(Z,Z)-alpha-Farnesene
PHCD compound ID :
3062
Chemical Names :
(Z,Z)-alpha-Farnesene
Molecular Formula :
C15H24
Molecular Weight :
204.187801
More Details :
Names & Synonyms:
(3Z,6Z)-3,7,11-trimethyldodeca-1,3,6,10-tetraene
Smiles:
C=C/C(=C\C/C=C(\CCC=C(C)C)/C)/C
InChi :
InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9-10,12H,1,7-8,11H2,2-5H3/b14-10-,15-12-
InChi Key :
InChIKey=CXENHBSYCFFKJS-LOQWIJHWSA-N
PubChem ID :
5317320
Rotatable bond count :
6
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
9.012525
Hydrogen bond donor count :
0
Electric dipole moment :
1.007
XLogP :
6.136
VDW volume :
257.450393
Molecular weight :
204.187801
HOMO-LUMO gap :
10.123000
Herb list :
Carrot - Daucus carota - هویج
Hyssop - Hyssopus angustifolius - زوفا
Refrences & Litretures:
395. Journal:'Journal of Essential Oil Bearing Plants' Year:'2009' Volume:'12' Page:'111' DOI:'10.1080/0972060X.2009.10643700' Title:'Chemical Composition and Antimicrobial Activity of Essential Oil of Hyssopus angustifolius M.B'
738. Journal:'Grasas y Aceites' Year:'2007' Volume:'58' Page:'359' DOI:'' Title:'Chemical composition of carrot seeds (Daucus carota L.) cultivated in Turkey: characterization of the seed oil and essential oil'
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