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ScientificNameLabel
Limonene aldehyde
PHCD compound ID : 4198
Chemical Names :
Limonene aldehyde
Molecular Formula : C11H18O1
Molecular Weight : 166.135765
More Details :
Names & Synonyms: 3-(4-methylcyclohex-3-en-1-yl)butanal , 3-(4-methyl-1-cyclohex-3-enyl)butanal , 3-(4-methylcyclohex-3-en-1-yl)butyraldehyde
Smiles: O=CC[C@@H]([C@@H]1CCC(=CC1)C)C
InChi : InChI=1S/C11H18O/c1-9-3-5-11(6-4-9)10(2)7-8-12/h3,8,10-11H,4-7H2,1-2H3/t10-,11-/m0/s1
InChi Key : InChIKey=VJYFMQREUJXCQV-QWRGUYRKSA-N
PubChem ID : 110923
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.264881
Hydrogen bond donor count : 0 Electric dipole moment : 2.781
XLogP : 3.654 VDW volume : 189.97314
Molecular weight : 166.135765 HOMO-LUMO gap : 10.074000
Herb list :
Refrences & Litretures:
  
605.      Journal:'J Sci Food Agric'      Year:'2013'      Volume:'93'      Page:'2494'      DOI:'10.1002/jsfa.6065'      Title:'Chemical constituents and anti-ulcerogenic potential of the scales of Cynara scolymus (artichoke) heads'
939.      Journal:'Cellular and Molecular Biology'      Year:'2017'      Volume:'63'      Page:'1'      DOI:'10.14715/cmb/2017.63.9.1'      Title:'Bioactive chemical compounds in Eremurus persicus (Joub. & Spach) Boiss. essential oil and their health implications'
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