In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP03059AAE
Common NameLPS(14:0/0:0)
Systematic Name1-tetradecanoyl-sn-glycero-3-phosphoserine
Synonyms-
Exact Mass
469.2441 (neutral)    Calculate m/z:
FormulaC20H40NO9P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoserines [GP03]
Sub ClassMonoacylglycerophosphoserines [GP0305]
PubChem Compound ID (CID)-
InChIKeyZJMQYSXCPARLHG-MSOLQXFVSA-N
InChIInChI=1S/C20H40NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-19(23)28-14-17(22)15-29-31(26
,27)30-16-18(21)20(24)25/h17-18,22H,2-16,21H2,1H3,(H,24,25)(H,26,27)/t17-,18+/m1
/s1
SMILESC(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(O)COC(CCCCCCCCCCCCC)=O)(=O)O
MS Spectra-     
StatusActive (generated by computational methods)