Lipid 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1’-myo-inositol-4’,5’-bisphosphate)

Name 1-stearoyl-2-arachidonoyl-sn-glycero-3-phospho-(1’-myo-inositol-4’,5’-bisphosphate)
Molecule SAPI24
Used in: Browse Experiments/Simulations Browse Simulations with Quality
Image Lipid Image
Show on GitHub Molecules/membrane/SAPI24 main
Property Value
iupacName [(1R,2S,3R,4R,5S,6R)-2,3,5-trihydroxy-4-[[2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-3-octadecanoyloxypropoxy]-oxidophosphoryl]oxy-6-phosphonatooxycyclohexyl] phosphate
molecularFormula C47H80O19P3-5
molecularWeight 1042
inChI InChI=1S/C47H85O19P3/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(49)63-39(37-61-40(48)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2)38-62-69(59,60)66-45-42(50)43(51)46(64-67(53,54)55)47(44(45)52)65-68(56,57)58/h11,13,17,19,22,24,28,30,39,42-47,50-52H,3-10,12,14-16,18,20-21,23,25-27,29,31-38H2,1-2H3,(H,59,60)(H2,53,54,55)(H2,56,57,58)/p-5/b13-11-,19-17-,24-22-,30-28-/t39?,42-,43+,44+,45-,46-,47-/m1/s1
inChIKey CNWINRVXAYPOMW-WJUYXORRSA-I
smiles CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1O)OP(=O)([O-])[O-])OP(=O)([O-])[O-])O)O)OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
image https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=24742074&t=l
Database External ID
pubchem.compound 24742074
  • BDBM15235
  • CHEBI:232300
  • L-alpha-Phosphatidylinositol 4,5-bisphosphate
  • Phosphatidylinositol-4,5-bisphosphate (PIP2)
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