In-Silico Structure Database (LMISSD)
Common Name
PIP2[4',5'](O-22:0/32:0)
Systematic Name
1-docosyl-2-dotriacontanoyl-sn-glycero-3-phosphoinositol-4,5-bisphosphate
LM ID
LMGP08029C07
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1264.823534
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol bisphosphates [GP08]
1-alkyl,2-acylglycerophosphoinositol bisphosphates [GP0802]
String Representations
InChiKey (Click to copy)
REVUDPIVQNEJBL-GSBUOYCVSA-N
InChi (Click to copy)
InChI=1S/C63H127O18P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-32-33-34-36-38-40-42-44-46-48-50-52-57(64)78-56(54-76-53-51-49-47-45-43-41-39-37-35-24-22-20-18-16-14-12-10-8-6-4-2)55-77-84(74,75)81-61-58(65)59(66)62(79-82(68,69)70)63(60(61)67)80-83(71,72)73/h56,58-63,65-67H,3-55H2,1-2H3,(H,74,75)(H2,68,69,70)(H2,71,72,73)/t56-,58?,59+,60?,61-,62?,63?/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1O)COCCCCCCCCCCCCCCCCCCCCCC