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ScientificNameLabel
Zingiberenol
PHCD compound ID : 3011
Chemical Names :
Zingiberenol
Molecular Formula : C15H26O1
Molecular Weight : 222.198365
More Details :
Names & Synonyms: 4-(1,5-dimethylhex-4-enyl)-1-methyl-cyclohex-2-en-1-ol , 1-methyl-4-(6-methylhept-5-en-2-yl)-1-cyclohex-2-enol , 1-methyl-4-(6-methylhept-5-en-2-yl)cyclohex-2-en-1-ol
Smiles: CC(=CCC[C@H]([C@H]1CC[C@](C=C1)(C)O)C)C
InChi : InChI=1S/C15H26O/c1-12(2)6-5-7-13(3)14-8-10-15(4,16)11-9-14/h6,8,10,13-14,16H,5,7,9,11H2,1-4H3/t13-,14-,15-/m1/s1
InChi Key : InChIKey=VVCHIOKYQRUBED-RBSFLKMASA-N
PubChem ID : 13213649
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.241311
Hydrogen bond donor count : 1 Electric dipole moment : 2.281
XLogP : 4.697 VDW volume : 259.157079
Molecular weight : 222.198365 HOMO-LUMO gap : 10.395000
Herb list :
Refrences & Litretures:
  
380.      Journal:'Food and Chemical Toxicology'      Year:'2008'      Volume:'46'      Page:'3295'      DOI:'10.1016/j.fct.2008.07.017'      Title:'Chemistry, antioxidant and antimicrobial investigations on essential oil and oleoresins of Zingiber officinale'
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