In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP05059ABB
Common NameLPGP(20:1(11Z)/0:0)
Systematic Name1-(11Z-eicosenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
Synonyms-
Exact Mass
618.2934 (neutral)    Calculate m/z:
FormulaC26H52O12P2
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoglycerophosphates [GP05]
Sub ClassMonoacylglycerophosphoglycerophosphates [GP0505]
PubChem Compound ID (CID)-
InChIKeyJZHRZTOMLCUEPC-MVKCUJKCSA-N
InChIInChI=1S/C26H52O12P2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)35-2
0-24(27)22-37-40(33,34)38-23-25(28)21-36-39(30,31)32/h9-10,24-25,27-28H,2-8,11-2
3H2,1H3,(H,33,34)(H2,30,31,32)/b10-9-/t24-,25+/m1/s1
SMILES[H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(O)COC(CCCCCCCCC/C=CCCCCCCCC)=O)(=O)O
MS Spectra-     
StatusActive (generated by computational methods)