In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP05059ACU
Common NameLPGP(0:0/16:1(7Z))
Systematic Name2-(7Z-hexadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
Synonyms-
Exact Mass
562.2308 (neutral)    Calculate m/z:
FormulaC22H44O12P2
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoglycerophosphates [GP05]
Sub ClassMonoacylglycerophosphoglycerophosphates [GP0505]
PubChem Compound ID (CID)-
InChIKeyUYRCYAFFLMMAIS-AXTSOQQGSA-N
InChIInChI=1S/C23H46O12P2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23(26)35-22(17-24)2
0-34-37(30,31)33-19-21(25)18-32-36(27,28)29/h9-10,21-22,24-25H,2-8,11-20H2,1H3,(
H,30,31)(H2,27,28,29)/b10-9-/t21-,22+/m0/s1
SMILES[H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCCCCC/C=CCCCCCCCC)=O)CO)(=O)O
MS Spectra-     
StatusActive (generated by computational methods)