In-Silico Structure Database (LMISSD)
Common Name
PS(31:0/20:1(11Z))
Systematic Name
1-hentriacontanoyl-2-(11Z-eicosenoyl)-sn-glycero-3-phosphoserine
LM ID
LMGP03019E1X
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
999.786737
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoserines [GP03]
Diacylglycerophosphoserines [GP0301]
String Representations
InChiKey (Click to copy)
VQBQOODROXLELJ-WJMQQZCKSA-N
InChi (Click to copy)
InChI=1S/C57H110NO10P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-33-34-36-38-40-42-44-46-48-55(59)65-50-53(51-66-69(63,64)67-52-54(58)57(61)62)68-56(60)49-47-45-43-41-39-37-35-32-20-18-16-14-12-10-8-6-4-2/h18,20,53-54H,3-17,19,21-52,58H2,1-2H3,(H,61,62)(H,63,64)/b20-18-/t53-,54+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCC/C=C\CCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(=O)O