In-Silico Structure Database (LMISSD)
Common Name
PIP2[3',4'](O-20:0/36:0)
Systematic Name
1-eicosyl-2-hexatriacontanoyl-sn-glycero-3-phosphoinositol-3,4-bisphosphate
LM ID
LMGP08029ASM
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1292.854834
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol bisphosphates [GP08]
1-alkyl,2-acylglycerophosphoinositol bisphosphates [GP0802]
String Representations
InChiKey (Click to copy)
HJKWGOUAGULLJW-PLXUSJNSSA-N
InChi (Click to copy)
InChI=1S/C65H131O18P3/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-54-59(66)80-58(56-78-55-53-51-49-47-45-43-41-39-22-20-18-16-14-12-10-8-6-4-2)57-79-86(76,77)83-63-60(67)61(68)64(81-84(70,71)72)65(62(63)69)82-85(73,74)75/h58,60-65,67-69H,3-57H2,1-2H3,(H,76,77)(H2,70,71,72)(H2,73,74,75)/t58-,60?,61?,62?,63+,64?,65+/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O)(O)O)C(O)C1O)COCCCCCCCCCCCCCCCCCCCC