In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP03019AAG
Common NamePS(10:0/15:0)
Systematic Name1-decanoyl-2-pentadecanoyl-sn-glycero-3-phosphoserine
SynonymsPS(25:0); PS(10:0_15:0)
Exact Mass
637.3955 (neutral)    Calculate m/z:
FormulaC31H60NO10P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoserines [GP03]
Sub ClassDiacylglycerophosphoserines [GP0301]
PubChem Compound ID (CID)-
InChIKeyHHDIRJUXVWKSFL-IZLXSDGUSA-N
InChIInChI=1S/C31H60NO10P/c1-3-5-7-9-11-12-13-14-15-17-19-21-23-30(34)42-27(25-40-43(
37,38)41-26-28(32)31(35)36)24-39-29(33)22-20-18-16-10-8-6-4-2/h27-28H,3-26,32H2,
1-2H3,(H,35,36)(H,37,38)/t27-,28+/m1/s1
SMILESC(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCC)=O)COC(CCCCCCCCC)=O)(=O)O
MS Spectra-      Predict MS/MS spectrum (Neg. mode)
StatusActive (generated by computational methods)