In-Silico Structure Database (LMISSD)
Common Name
LPI(0:0/20:4(5Z,8Z,10E,14Z))
Systematic Name
2-(5Z,8Z,10E,14Z-eicosatetraenoyl)-sn-glycero-3-phosphoinositol
LM ID
LMGP06059ADU
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
620.296168
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositols [GP06]
Monoacylglycerophosphoinositols [GP0605]
String Representations
InChiKey (Click to copy)
CVPJRLFFPXGIQP-SDFMPCLOSA-N
InChi (Click to copy)
InChI=1S/C29H49O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(31)40-22(20-30)21-39-42(37,38)41-29-27(35)25(33)24(32)26(34)28(29)36/h6-7,10-13,15-16,22,24-30,32-36H,2-5,8-9,14,17-21H2,1H3,(H,37,38)/b7-6-,11-10+,13-12-,16-15-/t22-,24?,25-,26?,27?,28?,29-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCC/C=CC/C=CC=CCC/C=CCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)CO