In-Silico Structure Database (LMISSD)
Common Name
LPIP3[3',4',5'](P-16:1(11Z)/0:0)
Systematic Name
1-(1Z,11Z-hexadecadienyl)-sn-glycero-3-phosphoinositol-3,4,5-trisphosphate
LM ID
LMGP09069AAC
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
794.184602
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol trisphosphates [GP09]
1Z-alkenylglycerophosphoinositol trisphosphates [GP0906]
String Representations
InChiKey (Click to copy)
LHRNINXAPIEJHN-SHWAJVQXSA-N
InChi (Click to copy)
InChI=1S/C25H50O20P4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-40-17-19(26)18-41-49(38,39)45-22-20(27)23(42-46(29,30)31)25(44-48(35,36)37)24(21(22)28)43-47(32,33)34/h5-6,15-16,19-28H,2-4,7-14,17-18H2,1H3,(H,38,39)(H2,29,30,31)(H2,32,33,34)(H2,35,36,37)/b6-5-,16-15-/t19-,20?,21?,22-,23+,24?,25?/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)CO/C=CCCCCCCCC/C=CCCCC