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ScientificNameLabel
E-Sabinene hydrate
PHCD compound ID : 822
Chemical Names :
(E)-Sabinene hydrate , E-Sabinene hydrate
Molecular Formula : C10H18O1
Molecular Weight : 154.135765
More Details :
Names & Synonyms: (1S,4S,5R)-1-isopropyl-4-methyl-bicyclo[3.1.0]hexan-4-ol , (1S,4S,5R)-4-methyl-1-propan-2-yl-4-bicyclo[3.1.0]hexanol , (1S,4S,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-4-ol , (1S,4S,5R)-4-methyl-1-propan-2-yl-bicyclo[3.1.0]hexan-4-ol
Smiles: CC([C@]12CC[C@]([C@@H]2C1)(C)O)C
InChi : InChI=1S/C10H18O/c1-7(2)10-5-4-9(3,11)8(10)6-10/h7-8,11H,4-6H2,1-3H3/t8-,9-,10-/m0/s1
InChi Key : InChIKey=KXSDPILWMGFJMM-GUBZILKMSA-N
PubChem ID : 20055523
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 10.245679
Hydrogen bond donor count : 1 Electric dipole moment : 2.156
XLogP : 2.756 VDW volume : 165.593614
Molecular weight : 154.135765 HOMO-LUMO gap : 12.625000
Herb list :
Refrences & Litretures:
  
60.      Journal:'Food Control'      Year:'2008'      Volume:'19'      Page:'681'      DOI:'10.1016/j.foodcont.2007.07.007'      Title:'Antimicrobial activity and chemical composition of Thymus vulgaris, Thymus zygis and Thymus hyemalis essential oils'
70.      Journal:'Journal of Pharmaceutical and Biomedical Analysis'      Year:'2002'      Volume:'29'      Page:'691'      DOI:''      Title:'GC/MS evaluation of thyme (Thymus vulgaris L.) oil composition and variations during the vegetative cycle'
72.      Journal:'Industrial Crops and Products'      Year:'2006'      Volume:'24'      Page:'253'      DOI:'10.1016/j.indcrop.2006.06.011'      Title:'Seasonal variation of Thymus hyemalis Lange and Spanish Thymus vulgaris L. essential oils composition'
665.      Journal:'Plant Biosystem'      Year:'2016'      Volume:''      Page:''      DOI:'10.1080/11263504.2016.1187681'      Title:'Chemical composition and bioactivity of Boswellia serrata Roxb. essential oil in relation to geographical variation'
779.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2013'      Volume:'16'      Page:'59'      DOI:'10.1080/0972060X.2013.764190'      Title:'Essential Oil Composition, Total Phenolic Content, Antioxidant Activity and Antifungal Properties of Iranian Thymus daenensis subsp. Daenensis Celak. as in Influenced by Ontogenetical Variation'
866.      Journal:'Journal of Pharmacognosy and Phytochemistry'      Year:'2016'      Volume:'5'      Page:'99'      DOI:''      Title:'Steam distillation extraction and chemical composition of essential oils of Toddalia asiatica L. and Eucalyptus camaldulensis Dehnh'
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