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Compound: 5546
Plants: 312
References: 992
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Alpha-yelangen
ScientificNameLabel
Alpha-yelangen
PHCD compound ID :
1832
Chemical Names :
Alpha-yelangen
Molecular Formula :
C15H24
Molecular Weight :
204.187801
More Details :
Names & Synonyms:
Smiles:
CC([C@@H]1CC[C@]2([C@H]3[C@@H]1[C@@H]2C(=CC3)C)C)C
InChi :
InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12+,13+,14-,15-/m0/s1
InChi Key :
InChIKey=VLXDPFLIRFYIME-QRTUWBSPSA-N
PubChem ID :
25243882
Rotatable bond count :
1
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
8.984915
Hydrogen bond donor count :
0
Electric dipole moment :
0.444
XLogP :
6.499
VDW volume :
228.290393
Molecular weight :
204.187801
HOMO-LUMO gap :
10.340000
Herb list :
Lemongrass - Cymbopogon olivieri - پوتار، ناگرد، کاه مکی
Refrences & Litretures:
212. Journal:'Iranian Journal of Pharmaceutical Research' Year:'2006' Volume:'1' Page:'65' DOI:'' Title:'Antimicrobial Activity and Composition of the Essential Oil of Cymbopogon Olivieri (Boiss.) Bor from Iran'
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