In-Silico Structure Database (LMISSD)
Common Name
PG(P-18:0/29:0)
Systematic Name
1-(1Z-octadecenyl)-2-nonacosanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04039AI7
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
916.749623
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
1-(1Z-alkenyl),2-acylglycerophosphoglycerols [GP0403]
String Representations
InChiKey (Click to copy)
DFHSMCQHNPVEAZ-IOPLFUFGSA-N
InChi (Click to copy)
InChI=1S/C53H105O9P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-33-35-37-39-41-43-45-53(56)62-52(50-61-63(57,58)60-48-51(55)47-54)49-59-46-44-42-40-38-36-34-32-20-18-16-14-12-10-8-6-4-2/h44,46,51-52,54-55H,3-43,45,47-50H2,1-2H3,(H,57,58)/b46-44-/t51-,52+/m0/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)CO/C=C\CCCCCCCCCCCCCCCC