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ScientificNameLabel
(+)-annabichromenic acid
PHCD compound ID : 3495
Chemical Names :
(+)-annabichromenic acid , (-)-annabichromenic acid
Molecular Formula : C22H30O4
Molecular Weight : 358.214409
More Details :
Names & Synonyms: 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-chromene-6-carboxylic acid , 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentyl-1-benzopyran-6-carboxylic acid , 5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-7-pentylchromene-6-carboxylic acid , 2-methyl-2-(4-methylpent-3-enyl)-5-oxidanyl-7-pentyl-chromene-6-carboxylic acid , 7-amyl-5-hydroxy-2-methyl-2-(4-methylpent-3-enyl)chromene-6-carboxylic acid
Smiles: CCCCCc1cc2O[C@@](C)(CCC=C(C)C)C=Cc2c(c1C(=O)O)O
InChi : InChI=1S/C22H30O4/c1-5-6-7-10-16-14-18-17(20(23)19(16)21(24)25)11-13-22(4,26-18)12-8-9-15(2)3/h9,11,13-14,23H,5-8,10,12H2,1-4H3,(H,24,25)/t22-/m0/s1
InChi Key : InChIKey=HRHJHXJQMNWQTF-QFIPXVFZSA-N
PubChem ID : 3084339
Rotatable bond count : 8 Rule of five : 1
Hydrogen bond acceptor count : 4 Ionization potential : 8.872770
Hydrogen bond donor count : 2 Electric dipole moment : 1.959
XLogP : 6.06 VDW volume : 372.797358
Molecular weight : 358.214409 HOMO-LUMO gap : 8.404000
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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