In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP01079AAG
Common NameLPC(P-18:1(9Z)/0:0)
Systematic Name1-(1Z,9Z-octadecadienyl)-sn-glycero-3-phosphocholine
Synonyms-
Exact Mass
505.3532 (neutral)    Calculate m/z:
FormulaC26H52NO6P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphocholines [GP01]
Sub Class1Z-alkenylglycerophosphocholines [GP0107]
PubChem Compound ID (CID)-
InChIKeyKJUNGQXFZYMUOH-FKWLWHCOSA-N
InChIInChI=1S/C26H52NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-26(28
)25-33-34(29,30)32-23-21-27(2,3)4/h12-13,20,22,26,28H,5-11,14-19,21,23-25H2,1-4H
3/b13-12-,22-20-/t26-/m1/s1
SMILES[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(O)CO/C=CCCCCCC/C=CCCCCCCCC
MS Spectra-     
StatusActive (generated by computational methods)