In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP01059AA6
Common NameLPC(18:4(6Z,9Z,12Z,15Z)/0:0)
Systematic Name1-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycero-3-phosphocholine
Synonyms-
Exact Mass
515.3012 (neutral)    Calculate m/z:
FormulaC26H46NO7P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphocholines [GP01]
Sub ClassMonoacylglycerophosphocholines [GP0105]
PubChem Compound ID (CID)-
InChIKeyRVSJNDKZLRQIIG-VDNIJTNNSA-N
InChIInChI=1S/C26H46NO7P/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/h6-7,9-10,12-13,15-16,25,28H,5,8,11,14,17-2
4H2,1-4H3/b7-6-,10-9-,13-12-,16-15-/t25-/m1/s1
SMILES[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(O)COC(CCCC/C=CC/C=CC/C=CC/C=CCC)=O
MS Spectra-     
StatusActive (generated by computational methods)