In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP03059AAJ
Common NameLPS(16:1(7Z)/0:0)
Systematic Name1-(7Z-hexadecenoyl)-sn-glycero-3-phosphoserine
Synonyms-
Exact Mass
495.2597 (neutral)    Calculate m/z:
FormulaC22H42NO9P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoserines [GP03]
Sub ClassMonoacylglycerophosphoserines [GP0305]
PubChem Compound ID (CID)-
InChIKeyFNUMHYLZMNLICD-VSEBXTFHSA-N
InChIInChI=1S/C22H42NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(25)30-16-19(24)17-31
-33(28,29)32-18-20(23)22(26)27/h9-10,19-20,24H,2-8,11-18,23H2,1H3,(H,26,27)(H,28
,29)/b10-9-/t19-,20+/m1/s1
SMILESC(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(O)COC(CCCCC/C=CCCCCCCCC)=O)(=O)O
MS Spectra-     
StatusActive (generated by computational methods)