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ScientificNameLabel
Cannabinodivarin
PHCD compound ID : 3523
Chemical Names :
Cannabinodivarin
Molecular Formula : C19H22O2
Molecular Weight : 282.16198
More Details :
Names & Synonyms: 2-(2-isopropenyl-5-methyl-phenyl)-5-propyl-benzene-1,3-diol , 2-[5-methyl-2-(1-methylethenyl)phenyl]-5-propylbenzene-1,3-diol , 2-(5-methyl-2-prop-1-en-2-ylphenyl)-5-propylbenzene-1,3-diol , 2-(5-methyl-2-prop-1-en-2-yl-phenyl)-5-propyl-benzene-1,3-diol , 2-(2-isopropenyl-5-methyl-phenyl)-5-propyl-resorcinol
Smiles: CCCc1cc(O)c(c(c1)O)c1cc(C)ccc1C(=C)C
InChi : InChI=1S/C19H22O2/c1-5-6-14-10-17(20)19(18(21)11-14)16-9-13(4)7-8-15(16)12(2)3/h7-11,20-21H,2,5-6H2,1,3-4H3
InChi Key : InChIKey=COURSARJQZMTEZ-UHFFFAOYSA-N
PubChem ID : 59444390
Rotatable bond count : 4 Rule of five : 1
Hydrogen bond acceptor count : 2 Ionization potential : 8.878541
Hydrogen bond donor count : 2 Electric dipole moment : 3.114
XLogP : 5.343 VDW volume : 289.792492
Molecular weight : 282.16198 HOMO-LUMO gap : 9.080000
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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