In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP05059AB7
Common NameLPGP(26:2(5Z,9Z)/0:0)
Systematic Name1-(5Z,9Z-hexacosadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
Synonyms-
Exact Mass
700.3717 (neutral)    Calculate m/z:
FormulaC32H62O12P2
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoglycerophosphates [GP05]
Sub ClassMonoacylglycerophosphoglycerophosphates [GP0505]
PubChem Compound ID (CID)-
InChIKeyFFUGKPLSXCMDNG-FXHKCHJLSA-N
InChIInChI=1S/C32H62O12P2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-2
3-24-25-32(35)41-26-30(33)28-43-46(39,40)44-29-31(34)27-42-45(36,37)38/h17-18,21
-22,30-31,33-34H,2-16,19-20,23-29H2,1H3,(H,39,40)(H2,36,37,38)/b18-17-,22-21-/t3
0-,31+/m1/s1
SMILES[H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(O)COC(CCC/C=CCC/C=CCCCCCCCCCCCCCCCC)=O)(=
O)O
MS Spectra-     
StatusActive (generated by computational methods)