In-Silico Structure Database (LMISSD)
Common Name
PI(O-14:0/14:0)
Systematic Name
1-tetradecyl-2-tetradecanoyl-sn-glycero-3-phosphoinositol
LM ID
LMGP06029AAE
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
740.483968
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositols [GP06]
1-alkyl,2-acylglycerophosphoinositols [GP0602]
String Representations
InChiKey (Click to copy)
GHSCHYPBSTYMLM-KHEJXBRSSA-N
InChi (Click to copy)
InChI=1S/C37H73O12P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-46-28-30(48-31(38)26-24-22-20-18-16-14-12-10-8-6-4-2)29-47-50(44,45)49-37-35(42)33(40)32(39)34(41)36(37)43/h30,32-37,39-43H,3-29H2,1-2H3,(H,44,45)/t30-,32?,33-,34?,35?,36?,37-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)COCCCCCCCCCCCCCC