In-Silico Structure Database (LMISSD)
Common Name
PG(O-16:1(11Z)/16:0)
Systematic Name
1-(11Z-hexadecenyl)-2-hexadecanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04029AHF
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
706.514873
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
1-alkyl,2-acylglycerophosphoglycerols [GP0402]
String Representations
InChiKey (Click to copy)
UKMFRNFHOOZKFI-KBHCBURQSA-N
InChi (Click to copy)
InChI=1S/C38H75O9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-44-34-37(35-46-48(42,43)45-33-36(40)32-39)47-38(41)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h9,11,36-37,39-40H,3-8,10,12-35H2,1-2H3,(H,42,43)/b11-9-/t36-,37+/m0/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)COCCCCCCCCCC/C=C\CCCC