In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP01069AAM
Common NameLPC(O-22:0/0:0)
Systematic Name1-docosyl-sn-glycero-3-phosphocholine
Synonyms-
Exact Mass
565.4471 (neutral)    Calculate m/z:
FormulaC30H64NO6P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphocholines [GP01]
Sub ClassMonoalkylglycerophosphocholines [GP0106]
PubChem Compound ID (CID)-
InChIKeyXFOSVRQLSZRDHZ-SSEXGKCCSA-N
InChIInChI=1S/C30H64NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26
-35-28-30(32)29-37-38(33,34)36-27-25-31(2,3)4/h30,32H,5-29H2,1-4H3/t30-/m1/s1
SMILES[C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(O)COCCCCCCCCCCCCCCCCCCCCCC
MS Spectra-     
StatusActive (generated by computational methods)