20-Trifluoromethyl-Leukotriene B4

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Properties Simple | Detailed

Formula C20H29F3O4
IUPAC Name (5s,6z,8e,10e,12r,14z)-20,20,20-trifluoro-5,12-dihydroxy-icosa-6,8,10,14-tetraenoic acid
Molecular Mass 390.437 g·mol−1
Heat of Formation -1417.5 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 494.19 Å 3
Surface Area 406.94 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
Synonyms
  • (5s,6z,8e,10e,12r,14z)-20,20,20-trifluoro-5,12-dihydroxy-icosa-6,8,10,14-tetraenoic acid
  • (5s,6z,8e,10e,12r,14z)-20,20,20-trifluoro-5,12-dihydroxyicosa-6,8,10,14-tetraenoic acid
  • 20,20,20-trifluoroleukotriene b4
  • 20-tfm ltb4
  • 20-trifluoro-ltb4
  • 20-trifluoromethylleukotriene b4
  • 5s,12r-dihydroxy-20,20,20-trifluoro-6z,8e,10e,14z-eicosatetraenoic acid
  • 6,3,10,14-eicosatetraenoic acid, 20,20,20-trifluoro-5,12-dihydroxy-, (s(r*,s*-(e,z,e,z)))-
  • 6,8,10,14-eicosatetraenoic acid, 20,20,20-trifluoro-5,12-dihydroxy-, (s-(r*,s*-(e,z,e,z)))-
  • lmfa03020019
CAS Number(s)
  • 115178-97-7
InChIKey YKIRCSCMMMEEDI-QAASZIRWSA-N
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