In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP05059ABY
Common NameLPGP(23:0/0:0)
Systematic Name1-tricosanoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
Synonyms-
Exact Mass
662.3560 (neutral)    Calculate m/z:
FormulaC29H60O12P2
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphoglycerophosphates [GP05]
Sub ClassMonoacylglycerophosphoglycerophosphates [GP0505]
PubChem Compound ID (CID)-
InChIKeyHXHJKUNIPOHJNH-IZLXSDGUSA-N
InChIInChI=1S/C29H60O12P2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-2
9(32)38-23-27(30)25-40-43(36,37)41-26-28(31)24-39-42(33,34)35/h27-28,30-31H,2-26
H2,1H3,(H,36,37)(H2,33,34,35)/t27-,28+/m1/s1
SMILES[H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(O)COC(CCCCCCCCCCCCCCCCCCCCCC)=O)(=O)O
MS Spectra-     
StatusActive (generated by computational methods)