In-Silico Structure Database (LMISSD)
Common Name
PG(O-14:0/18:2(6Z,9Z))
Systematic Name
1-tetradecyl-2-(6Z,9Z-octadecadienoyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
LM ID
LMGP04029AAZ
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
704.499223
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerols [GP04]
1-alkyl,2-acylglycerophosphoglycerols [GP0402]
String Representations
InChiKey (Click to copy)
NVJZDBMDTFBRBF-XGUJSXPPSA-N
InChi (Click to copy)
InChI=1S/C38H73O9P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-38(41)47-37(35-46-48(42,43)45-33-36(40)32-39)34-44-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h17-18,20,22,36-37,39-40H,3-16,19,21,23-35H2,1-2H3,(H,42,43)/b18-17-,22-20-/t36-,37+/m0/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCC/C=C\C/C=C\CCCCCCCC)=O)(COP(=O)(O)OC[C@@]([H])(O)CO)COCCCCCCCCCCCCCC