In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP10039AE2
Common NamePA(P-16:1(9Z)/15:0)
Systematic Name1-(1Z,9Z-hexadecadienyl)-2-pentadecanoyl-sn-glycero-3-phosphate
SynonymsPA(P-31:1); PA(P-16:1/15:0)
Exact Mass
616.4468 (neutral)    Calculate m/z:
FormulaC34H65O7P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphates [GP10]
Sub Class1-(1Z-alkenyl),2-acylglycerophosphates [GP1003]
PubChem Compound ID (CID)-
InChIKeyUHMZBXKYAYTXHH-YBDLGXKZSA-N
InChIInChI=1S/C34H65O7P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-39-31-33(32-40-42
(36,37)38)41-34(35)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h13,15,28,30,33H,3-12,1
4,16-27,29,31-32H2,1-2H3,(H2,36,37,38)/b15-13-,30-28-/t33-/m1/s1
SMILES[C@](COP(=O)(O)O)([H])(OC(CCCCCCCCCCCCCC)=O)CO/C=C\CCCCCC/C=C\CCCCCC
MS Spectra-      Predict MS/MS spectrum (Neg. mode)
StatusActive (generated by computational methods)