In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP05069AAF
Common NameLPGP(O-18:1(11Z)/0:0)
Systematic Name1-(11Z-octadecenyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
Synonyms-
Exact Mass
576.2828 (neutral)    Calculate m/z:
FormulaC24H50O11P2
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoglycerophosphates [GP05]
Sub ClassMonoalkylglycerophosphoglycerophosphates [GP0506]
PubChem Compound ID (CID)-
InChIKeyCKISFKLOIOVCBS-FGIKVYNHSA-N
InChIInChI=1S/C24H50O11P2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-32-19-23(25)2
1-34-37(30,31)35-22-24(26)20-33-36(27,28)29/h7-8,23-26H,2-6,9-22H2,1H3,(H,30,31)
(H2,27,28,29)/b8-7-/t23-,24+/m1/s1
SMILES[C@]([H])(O)(COP(=O)(O)OC[C@@]([H])(O)COP(O)(O)=O)COCCCCCCCCCC/C=CCCCCCC
MS Spectra-     
StatusActive (generated by computational methods)