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Compound: 5546
Plants: 312
References: 992
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iso-Menthone
ScientificNameLabel
iso-Menthone
PHCD compound ID :
1879
Chemical Names :
iso-Menthone
Molecular Formula :
C10H18O1
Molecular Weight :
154.135765
More Details :
Names & Synonyms:
(2R,5R)-2-isopropyl-5-methyl-cyclohexanone , (2R,5R)-5-methyl-2-propan-2-yl-1-cyclohexanone , (2R,5R)-5-methyl-2-propan-2-ylcyclohexan-1-one , (2R,5R)-5-methyl-2-propan-2-yl-cyclohexan-1-one
Smiles:
C[C@@H]1CC[C@@H](C(=O)C1)C(C)C
InChi :
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
InChi Key :
InChIKey=NFLGAXVYCFJBMK-RKDXNWHRSA-N
PubChem ID :
70962
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.738069
Hydrogen bond donor count :
0
Electric dipole moment :
3.461
XLogP :
2.798
VDW volume :
175.313614
Molecular weight :
154.135765
HOMO-LUMO gap :
10.768000
Herb list :
Elecampane, Inula - Inula helenium - زنجبیل شامی، مصفا
Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش
Penny royal, Flea mint - Mentha pulegium - پونه معطر، خال واش، کوت کوتی
Peppermint - Mentha piperita - نعنا فلفلی، نعنا
Small-leaved linden, Tillet tree - Tilia cordata - زیرفون، نمدار برگریز
Refrences & Litretures:
222. Journal:'Journal of Herbal Drugs' Year:'2014' Volume:'5' Page:'33' DOI:'' Title:'Essential oil composition of Pennyroyal (Mentha pulegium L.) from Southern Iran'
385. Journal:'Eur J Clin Microbiol Infect Dis' Year:'2012' Volume:'31' Page:'1015' DOI:'10.1007/s10096-011-1400-1' Title:'Antistaphylococcal activity of Inula helenium L. root essential oil: eudesmane sesquiterpene lactones induce cell membrane damage'
680. Journal:'BIOLOGIJA' Year:'2005' Volume:'4' Page:'53' DOI:'' Title:'Chemical composition of essential oil and antimicrobial activity of Origanum vulgare'
720. Journal:'food and bioproducts processing' Year:'2015' Volume:'94' Page:'50' DOI:'10.1016/j.fbp.2015.01.003' Title:'Extraction of essential oils from Mentha piperitausing advanced techniques: Microwave versusohmic assisted hydrodistillation'
873. Journal:'Journal of Essential Oil Bearing Plants' Year:'2017' Volume:'20' Page:'1137' DOI:'10.1080/0972060X.2017.1359681' Title:'Essential Oil Composition of Tilia cordata Flowers'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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