In-Silico Structure Database (LMISSD)
Common Name
PIP[5'](36:0/32:0)
Systematic Name
1-hexatriacontanoyl-2-dotriacontanoyl-sn-glycero-3-phosphoinositol-5-phosphate
LM ID
LMGP07019P08
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1395.055566
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol monophosphates [GP07]
Diacylglycerophosphoinositol monophosphates [GP0701]
String Representations
InChiKey (Click to copy)
UNZWKLCENOUKBC-ZZXJTVBKSA-N
InChi (Click to copy)
InChI=1S/C77H152O16P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-34-35-36-38-39-41-43-45-47-49-51-53-55-57-59-61-63-65-70(78)89-67-69(68-90-95(87,88)93-77-74(82)72(80)73(81)76(75(77)83)92-94(84,85)86)91-71(79)66-64-62-60-58-56-54-52-50-48-46-44-42-40-37-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h69,72-77,80-83H,3-68H2,1-2H3,(H,87,88)(H2,84,85,86)/t69-,72-,73?,74?,75?,76?,77-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O