In-Silico Structure Database (LMISSD)
Common Name
LPIP3[3',4',5'](11:0/0:0)
Systematic Name
1-undecanoyl-sn-glycero-3-phosphoinositol-3,4,5-trisphosphate
LM ID
LMGP09049AAB
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
742.116917
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol trisphosphates [GP09]
Monoacylglycerophosphoinositol trisphosphates [GP0904]
String Representations
InChiKey (Click to copy)
VXGGILDJOVRZBG-YFBBKPRMSA-N
InChi (Click to copy)
InChI=1S/C20H42O21P4/c1-2-3-4-5-6-7-8-9-10-14(22)36-11-13(21)12-37-45(34,35)41-17-15(23)18(38-42(25,26)27)20(40-44(31,32)33)19(16(17)24)39-43(28,29)30/h13,15-21,23-24H,2-12H2,1H3,(H,34,35)(H2,25,26,27)(H2,28,29,30)(H2,31,32,33)/t13-,15?,16?,17-,18+,19?,20?/m1/s1
SMILES (Click to copy)
[C@]([H])(O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCCC)=O