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ScientificNameLabel
Tetrahydrocannabiorcol
PHCD compound ID : 3507
Chemical Names :
Tetrahydrocannabiorcol
Molecular Formula : C17H22O2
Molecular Weight : 258.16198
More Details :
Names & Synonyms: (6aR,10aR)-3,6,6,9-tetramethyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol , (6aR,10aR)-3,6,6,9-tetramethyl-6a,7,8,10a-tetrahydrobenzo[c][1]benzopyran-1-ol
Smiles: CC1=C[C@@H]2[C@@H](CC1)C(C)(C)Oc1c2c(O)cc(c1)C
InChi : InChI=1S/C17H22O2/c1-10-5-6-13-12(7-10)16-14(18)8-11(2)9-15(16)19-17(13,3)4/h7-9,12-13,18H,5-6H2,1-4H3/t12-,13-/m1/s1
InChi Key : InChIKey=WIDIPARNVYRVNW-CHWSQXEVSA-N
PubChem ID : 22805649
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 8.683750
Hydrogen bond donor count : 1 Electric dipole moment : 0.759
XLogP : 3.658 VDW volume : 261.65344
Molecular weight : 258.16198 HOMO-LUMO gap : 9.193000
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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