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InChIKey | WTZSTDQUTJFPNI-TXPQBTCESA-G |
InChI | InChI=1S/C50H90O22P4/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-28-30-32-34-36-38-43(51)66-40-42(68-44(52)39-37-35-33-31-29-26-18-16-14-12-10-8-6-4-2)41-67-76(64,65)72-47-45(53)48(69-73(55,56)57)50(71-75(61,62)63)49(46(47)54)70-74(58,59)60/h11,13,17,19,21-22,24-25,28,30,42,45-50,53-54H,3-10,12,14-16,18,20,23,26-27,29,31-41H2,1-2H3,(H,64,65)(H2,55,56,57)(H2,58,59,60)(H2,61,62,63)/p-7/b13-11-,19-17-,22-21-,25-24-,30-28-/t42-,45+,46+,47-,48+,49-,50-/m1/s1 |
SMILES | [H]\C(CCCCC)=C(/[H])C\C([H])=C(\[H])C\C([H])=C(\[H])C\C([H])=C(\[H])C\C([H])=C(\[H])CCCCC(=O)OC[C@]([H])(COP([O-])(=O)O[C@]1([H])[C@]([H])(O)[C@]([H])(OP([O-])([O-])=O)[C@@]([H])(OP([O-])([O-])=O)[C@]([H])(OP([O-])([O-])=O)[C@@]1([H])O)OC(=O)CCCCCCCCCCCCCCCC |
Identifier | Description |
---|---|
slm:000442040 | 1-(6Z,9Z,12Z,15Z,18Z-tetracosapentaenoyl)-2-heptadecanoyl-sn-glycero-3-phospho-1D-myo-inositol-3,4,5-trisphosphate PIP3[3,4,5](24:5(6Z,9Z,12Z,15Z,18Z)/17:0) |