In-Silico Structure Database (LMISSD)
Common Name
PIP2[3',5'](34:0/32:0)
Systematic Name
1-tetratriacontanoyl-2-dotriacontanoyl-sn-glycero-3-phosphoinositol-3,5-bisphosphate
LM ID
LMGP08019KK9
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1446.990599
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol bisphosphates [GP08]
Diacylglycerophosphoinositol bisphosphates [GP0801]
String Representations
InChiKey (Click to copy)
KUHRCIMCVMMCRG-KFQZGEQISA-N
InChi (Click to copy)
InChI=1S/C75H149O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-34-36-37-39-41-43-45-47-49-51-53-55-57-59-61-63-68(76)89-65-67(66-90-97(87,88)94-75-71(79)73(92-95(81,82)83)70(78)74(72(75)80)93-96(84,85)86)91-69(77)64-62-60-58-56-54-52-50-48-46-44-42-40-38-35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h67,70-75,78-80H,3-66H2,1-2H3,(H,87,88)(H2,81,82,83)(H2,84,85,86)/t67-,70?,71?,72?,73-,74?,75-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(O)C(OP(=O)(O)O)C1O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O