In-Silico Structure database (LMISSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMGP10039DDM
Common NamePA(P-14:0/15:1(9Z))
Systematic Name1-(1Z-tetradecenyl)-2-(9Z-pentadecenoyl)-sn-glycero-3-phosphate
SynonymsPA(P-29:1); PA(P-14:0/15:1)
Exact Mass
588.4155 (neutral)    Calculate m/z:
FormulaC32H61O7P
CategoryGlycerophospholipids [GP]
Main ClassGlycerophosphates [GP10]
Sub Class1-(1Z-alkenyl),2-acylglycerophosphates [GP1003]
PubChem Compound ID (CID)-
InChIKeyRSVKWMZGWJXUNI-WRROGPFHSA-N
InChIInChI=1S/C32H61O7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32(33)39-31(30-38-40(34
,35)36)29-37-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,26,28,31H,3-10,12,14-2
5,27,29-30H2,1-2H3,(H2,34,35,36)/b13-11-,28-26-/t31-/m1/s1
SMILES[C@](COP(=O)(O)O)([H])(OC(CCCCCCC/C=C\CCCCC)=O)CO/C=C\CCCCCCCCCCCC
MS Spectra-      Predict MS/MS spectrum (Neg. mode)
StatusActive (generated by computational methods)