In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP01059AA2
Common NameLPC(18:2(9Z,11Z)/0:0)
Systematic Name1-(9Z,11Z-octadecadienoyl)-sn-glycero-3-phosphocholine
Synonyms-
Exact Mass
519.3325 (neutral)    Calculate m/z:
FormulaC26H50NO7P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphocholines [GP01]
Sub ClassMonoacylglycerophosphocholines [GP0105]
PubChem Compound ID (CID)-
InChIKeyAXFAVZQXPFQIEI-QKMAREPASA-N
InChIInChI=1S/C26H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25
(28)24-34-35(30,31)33-22-21-27(2,3)4/h10-13,25,28H,5-9,14-24H2,1-4H3/b11-10-,13-
12-/t25-/m1/s1
SMILES[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(O)COC(CCCCCCC/C=CC=C/CCCCCC)=O
MS Spectra-     
StatusActive (generated by computational methods)