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1,5-Epoxy-salvial(4)14-ene
ScientificNameLabel
1,5-Epoxy-salvial(4)14-ene
PHCD compound ID :
5366
Chemical Names :
1,5-Epoxy-salvial(4)14-ene
Molecular Formula :
C15H24O1
Molecular Weight :
220.182715
More Details :
Names & Synonyms:
5-isopropyl-2-methyl-8-methylene-11-oxatricyclo[5.3.1.02,6]undecane , 2-methyl-8-methylene-5-propan-2-yl-11-oxatricyclo[5.3.1.02,6]undecane , 2-methyl-8-methylidene-5-propan-2-yl-11-oxatricyclo[5.3.1.0
2,6
]undecane , 2-methyl-8-methylidene-5-propan-2-yl-11-oxatricyclo[5.3.1.02,6]undecane
Smiles:
CC([C@@H]1CC[C@@]2([C@H]1[C@@H]1O[C@H]2CCC1=C)C)C
InChi :
InChI=1S/C15H24O/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(16-12)13(11)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12-,13+,14+,15-/m0/s1
InChi Key :
InChIKey=BITBXAWCPCNKKN-AHDPXTMNSA-N
PubChem ID :
85669481
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.579452
Hydrogen bond donor count :
0
Electric dipole moment :
2.107
XLogP :
3.913
VDW volume :
237.08062
Molecular weight :
220.182715
HOMO-LUMO gap :
10.638000
Herb list :
Turpentine tree - Pistacia terebinthus - پسته کوهی
Refrences & Litretures:
883. Journal:'Pharmaceutical Biology' Year:'2004' Volume:'42' Page:'360' DOI:'10.1080/13880200490519677' Title:'Chemical Composition of Essential Oils from Leaves and Twigs of Pistacia lentiscus, Pistacia lentiscus var. chia, and Pistacia terebinthus from Turkey'
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