In-Silico Structure Database (LMISSD)
Common Name
PIP2[3',5'](10:0/22:4(7Z,10Z,13Z,16Z))
Systematic Name
1-decanoyl-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycero-3-phosphoinositol-3,5-bisphosphate
LM ID
LMGP08019FM6
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
962.395899
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol bisphosphates [GP08]
Diacylglycerophosphoinositol bisphosphates [GP0801]
String Representations
InChiKey (Click to copy)
OLKQDNJFEGMYDQ-GEWMNTSKSA-N
InChi (Click to copy)
InChI=1S/C41H73O19P3/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-24-26-28-30-35(43)57-33(31-55-34(42)29-27-25-23-10-8-6-4-2)32-56-63(53,54)60-41-37(45)39(58-61(47,48)49)36(44)40(38(41)46)59-62(50,51)52/h11-12,14-15,17-18,20-21,33,36-41,44-46H,3-10,13,16,19,22-32H2,1-2H3,(H,53,54)(H2,47,48,49)(H2,50,51,52)/b12-11-,15-14-,18-17-,21-20-/t33-,36?,37?,38?,39-,40?,41-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCC)=O