In-Silico Structure Database (LMISSD)
Common Name
PIP[5'](36:0/28:0)
Systematic Name
1-hexatriacontanoyl-2-octacosanoyl-sn-glycero-3-phosphoinositol-5-phosphate
LM ID
LMGP07019P04
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1338.992966
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol monophosphates [GP07]
Diacylglycerophosphoinositol monophosphates [GP0701]
String Representations
InChiKey (Click to copy)
CVQGKCNEECVPFL-CNSRLIDCSA-N
InChi (Click to copy)
InChI=1S/C73H144O16P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-31-32-33-34-35-36-38-39-41-43-45-47-49-51-53-55-57-59-61-66(74)85-63-65(64-86-91(83,84)89-73-70(78)68(76)69(77)72(71(73)79)88-90(80,81)82)87-67(75)62-60-58-56-54-52-50-48-46-44-42-40-37-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h65,68-73,76-79H,3-64H2,1-2H3,(H,83,84)(H2,80,81,82)/t65-,68-,69?,70?,71?,72?,73-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O