In-Silico Structure Database (LMISSD)
Common Name
PG(10:0/22:5(7Z,10Z,13Z,16Z,19Z))
Systematic Name
1-decanoyl-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04019ABV
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
712.431538
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
Diacylglycerophosphoglycerols [GP0401]
String Representations
InChiKey (Click to copy)
YXLIPPMKNAXPOR-YWIFQKOLSA-N
InChi (Click to copy)
InChI=1S/C38H65O10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-24-26-28-30-38(42)48-36(34-47-49(43,44)46-32-35(40)31-39)33-45-37(41)29-27-25-23-10-8-6-4-2/h5,7,11-12,14-15,17-18,20-21,35-36,39-40H,3-4,6,8-10,13,16,19,22-34H2,1-2H3,(H,43,44)/b7-5-,12-11-,15-14-,18-17-,21-20-/t35-,36+/m0/s1
SMILES (Click to copy)
[H][C@](O)(CO)COP(OC[C@]([H])(OC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCCCCC)=O)(=O)O