In-Silico Structure Database (LMISSD)
Common Name
PIP2[4',5'](15:0/10:0)
Systematic Name
1-pentadecanoyl-2-decanoyl-sn-glycero-3-phosphoinositol-4,5-bisphosphate
LM ID
LMGP08019LAU
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
872.348949
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol bisphosphates [GP08]
Diacylglycerophosphoinositol bisphosphates [GP0801]
String Representations
InChiKey (Click to copy)
OXIGTNAUBIHUOT-RUBCSVIJSA-N
InChi (Click to copy)
InChI=1S/C34H67O19P3/c1-3-5-7-9-11-12-13-14-15-17-18-20-22-27(35)48-24-26(50-28(36)23-21-19-16-10-8-6-4-2)25-49-56(46,47)53-32-29(37)30(38)33(51-54(40,41)42)34(31(32)39)52-55(43,44)45/h26,29-34,37-39H,3-25H2,1-2H3,(H,46,47)(H2,40,41,42)(H2,43,44,45)/t26-,29?,30+,31?,32-,33?,34?/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCCCCCCC)=O