In-Silico Structure Database (LMISSD)
Common Name
PGP(14:1(9Z)/31:0)
Systematic Name
1-(9Z-tetradecenoyl)-2-hentriacontanoyl-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
LM ID
LMGP05019ANV
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
982.663921
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoglycerophosphates [GP05]
Diacylglycerophosphoglycerophosphates [GP0501]
String Representations
InChiKey (Click to copy)
RLCIDAXAUWEHPX-ODEAQJSNSA-N
InChi (Click to copy)
InChI=1S/C51H100O13P2/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-33-35-37-39-41-43-51(54)64-49(47-63-66(58,59)62-45-48(52)44-61-65(55,56)57)46-60-50(53)42-40-38-36-34-32-14-12-10-8-6-4-2/h10,12,48-49,52H,3-9,11,13-47H2,1-2H3,(H,58,59)(H2,55,56,57)/b12-10-/t48-,49+/m0/s1
SMILES (Click to copy)
[H][C@](O)(COP(O)(O)=O)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCC/C=C\CCCC)=O)(=O)O