In-Silico Structure Database (LMISSD)
Common Name
PIP2[3',4'](10:0/10:0)
Systematic Name
1-2-di-decanoyl-sn-glycero-3-phosphoinositol-3,4-bisphosphate
LM ID
LMGP08019AAA
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
802.270699
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositol bisphosphates [GP08]
Diacylglycerophosphoinositol bisphosphates [GP0801]
String Representations
InChiKey (Click to copy)
LMLPYOCZRDPVQK-IFZCLTNBSA-N
InChi (Click to copy)
InChI=1S/C29H57O19P3/c1-3-5-7-9-11-13-15-17-22(30)43-19-21(45-23(31)18-16-14-12-10-8-6-4-2)20-44-51(41,42)48-27-24(32)25(33)28(46-49(35,36)37)29(26(27)34)47-50(38,39)40/h21,24-29,32-34H,3-20H2,1-2H3,(H,41,42)(H2,35,36,37)(H2,38,39,40)/t21-,24?,25?,26?,27+,28?,29+/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](OP(O)(=O)O)C(OP(=O)(O)O)C(O)C1O)COC(CCCCCCCCC)=O