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ScientificNameLabel
alpha-cedrane
PHCD compound ID : 1546
Chemical Names :
alpha-cedrane
Molecular Formula : C15H26
Molecular Weight : 206.203451
More Details :
Names & Synonyms:
Smiles: C[C@@H]1CC[C@@]23C[C@@H]1C(C)(C)[C@@H]2CC[C@H]3C
InChi : InChI=1S/C15H26/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h10-13H,5-9H2,1-4H3/t10-,11-,12+,13+,15+/m1/s1
InChi Key : InChIKey=JJTQQGNEXQKQRF-BIGJJFBESA-N
PubChem ID : 9548702
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 10.266371
Hydrogen bond donor count : 0 Electric dipole moment : 0.175
XLogP : 7.563 VDW volume : 230.926852
Molecular weight : 206.203451 HOMO-LUMO gap : 13.892000
Herb list :
Refrences & Litretures:
  
170.      Journal:'J. Crop Prot'      Year:'2012'      Volume:'1'      Page:'313'      DOI:''      Title:'Chemical composition and insecticide activity of lemon verbena essential oil'
452.      Journal:'J. Agric. Food Chem'      Year:'2004'      Volume:'52'      Page:'3915'      DOI:'10.1021/jf0353990'      Title:'Essential Oil of Valeriana officinalis L. Cultivars and Their Antimicrobial Activity As Influenced by Harvesting Time under Commercial Organic Cultivation'
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