In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP20049ABN
Common NamePS(10:0/4:0)
Systematic Name1-decanoyl-2-butyryl-sn-glycero-3-phosphoserine
SynonymsPS(14:0); PS(10:0/4:0)
Exact Mass
483.2233 (neutral)    Calculate m/z:
FormulaC20H38NO10P
CategoryGlycerophospholipids [GP]
Main ClassOxidized glycerophospholipids [GP20]
Sub ClassOxidized glycerophosphoserines [GP2004]
PubChem Compound ID (CID)-
InChIKeyQUGBZKZGJYXIIQ-SJORKVTESA-N
InChIInChI=1S/C20H38NO10P/c1-3-5-6-7-8-9-10-12-18(22)28-13-16(31-19(23)11-4-2)14-29-3
2(26,27)30-15-17(21)20(24)25/h16-17H,3-15,21H2,1-2H3,(H,24,25)(H,26,27)/t16-,17+
/m1/s1
SMILESC(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCC)=O)COC(CCCCCCCCC)=O)(=O)O
MS Spectra-      Predict MS/MS spectrum (Neg. mode)
StatusActive (generated by computational methods)