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Compound: 5546
Plants: 312
References: 992
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Z-alpha-farnesene
ScientificNameLabel
Z-alpha-farnesene
PHCD compound ID :
4365
Chemical Names :
(E, Z)-alpha-Farnesene , Z-alpha-farnesene
Molecular Formula :
C15H24
Molecular Weight :
204.187801
More Details :
Names & Synonyms:
(3E,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-DZKMRSEMSA-N
PubChem ID :
5353086
Rotatable bond count :
6
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
8.993929
Hydrogen bond donor count :
0
Electric dipole moment :
0.890
XLogP :
6.136
VDW volume :
257.450393
Molecular weight :
204.187801
HOMO-LUMO gap :
9.648000
Herb list :
Carrot - Daucus carota - هویج
Cow-parsnip - Heracleum persicum - گلپر
Refrences & Litretures:
647. Journal:'Iranian Journal of Pharmaceutical Research' Year:'2003' Volume:'2' Page:'245' DOI:'' Title:'Composition of the Essential Oil of the Root of Heracleum persicum from Iran'
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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