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ScientificNameLabel
Cannabigerol
PHCD compound ID : 3490
Chemical Names :
Cannabigerol
Molecular Formula : C21H32O2
Molecular Weight : 316.24023
More Details :
Names & Synonyms: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-5-pentyl-benzene-1,3-diol , 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-5-pentylbenzene-1,3-diol , 5-amyl-2-[(2E)-3,7-dimethylocta-2,6-dienyl]resorcinol
Smiles: CCCCCc1cc(O)c(c(c1)O)C/C=C(/CCC=C(C)C)\C
InChi : InChI=1S/C21H32O2/c1-5-6-7-11-18-14-20(22)19(21(23)15-18)13-12-17(4)10-8-9-16(2)3/h9,12,14-15,22-23H,5-8,10-11,13H2,1-4H3/b17-12+
InChi Key : InChIKey=QXACEHWTBCFNSA-SFQUDFHCSA-N
PubChem ID : 5315659
Rotatable bond count : 9 Rule of five : 1
Hydrogen bond acceptor count : 2 Ionization potential : 8.894049
Hydrogen bond donor count : 2 Electric dipole moment : 2.171
XLogP : 6.662 VDW volume : 352.913837
Molecular weight : 316.24023 HOMO-LUMO gap : 9.155000
Herb list :
Refrences & Litretures:
  
489.      Journal:'Life Sciences'      Year:'2005'      Volume:'78'      Page:'539'      DOI:'10.1016/j.lfs.2005.09.011'      Title:'Chemical constituents of marijuana: The complex mixture of natural cannabinoids'
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