In-Silico Structure Database (LMISSD)
Common Name
PIP2[3',5'](23:0/39:0)
Systematic Name
1-tricosanoyl-2-nonatriacontanoyl-sn-glycero-3-phosphoinositol-3,5-bisphosphate
LM ID
LMGP08019JH9
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1390.927999
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol bisphosphates [GP08]
Diacylglycerophosphoinositol bisphosphates [GP0801]
String Representations
InChiKey (Click to copy)
CHLYZECJUXRGSL-JZPSNRNESA-N
InChi (Click to copy)
InChI=1S/C71H141O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-42-44-46-48-50-52-54-56-58-60-65(73)87-63(61-85-64(72)59-57-55-53-51-49-47-45-43-41-24-22-20-18-16-14-12-10-8-6-4-2)62-86-93(83,84)90-71-67(75)69(88-91(77,78)79)66(74)70(68(71)76)89-92(80,81)82/h63,66-71,74-76H,3-62H2,1-2H3,(H,83,84)(H2,77,78,79)(H2,80,81,82)/t63-,66?,67?,68?,69-,70?,71-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCCCCCCCCCCCCCCC)=O