In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP09029A1Y
Common NamePIP3[3',4',5'](O-22:0/10:0)
Systematic Name1-docosyl-2-decanoyl-sn-glycero-3-phosphoinositol-3,4,5-trisphosphate
SynonymsPIP3[3',4',5'](O-32:0); PIP3(O-22:0_10:0)
Exact Mass
1036.4456 (neutral)    Calculate m/z:
FormulaC41H84O21P4
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoinositol trisphosphates [GP09]
Sub Class1-alkyl,2-acylglycerophosphoinositol trisphosphates [GP0902]
PubChem Compound ID (CID)-
InChIKey-
InChI-
SMILES[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
(OP(=O)(O)O)C1O)COCCCCCCCCCCCCCCCCCCCCCC
MS Spectra-     
StatusActive (generated by computational methods)