In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP04069AAD
Common NameLPG(O-16:1(9Z)/0:0)
Systematic Name1-(9Z-hexadecenyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
Synonyms-
Exact Mass
468.2852 (neutral)    Calculate m/z:
FormulaC22H45O8P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoglycerols [GP04]
Sub ClassMonoalkylglycerophosphoglycerols [GP0406]
PubChem Compound ID (CID)-
InChIKeyLIPKMZFHPLPLBH-UYRGJFBYSA-N
InChIInChI=1S/C22H45O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-28-18-22(25)20-30-31(
26,27)29-19-21(24)17-23/h7-8,21-25H,2-6,9-20H2,1H3,(H,26,27)/b8-7-/t21-,22+/m0/s
1
SMILES[C@]([H])(O)(COP(=O)(O)OC[C@@]([H])(O)CO)COCCCCCCCC/C=CCCCCCC
MS Spectra-     
StatusActive (generated by computational methods)