In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP02059AA6
Common NameLPE(18:4(6Z,9Z,12Z,15Z)/0:0)
Systematic Name1-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-sn-glycero-3-phosphoethanolamine
Synonyms-
Exact Mass
473.2542 (neutral)    Calculate m/z:
FormulaC23H40NO7P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoethanolamines [GP02]
Sub ClassMonoacylglycerophosphoethanolamines [GP0205]
PubChem Compound ID (CID)-
InChIKeyWPGYUFCFBKWCSL-JVBHARQXSA-N
InChIInChI=1S/C23H40NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25
)21-31-32(27,28)30-19-18-24/h3-4,6-7,9-10,12-13,22,25H,2,5,8,11,14-21,24H2,1H3,(
H,27,28)/b4-3-,7-6-,10-9-,13-12-/t22-/m1/s1
SMILES[C@](COP(=O)(O)OCCN)([H])(O)COC(CCCC/C=CC/C=CC/C=CC/C=CCC)=O
MS Spectra-     
StatusActive (generated by computational methods)