In-Silico Structure Database (LMISSD)
Common Name
PS(31:0/39:0)
Systematic Name
1-hentriacontanoyl-2-nonatriacontanoyl-sn-glycero-3-phosphoserine
LM ID
LMGP03019E26
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
1268.099737
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoserines [GP03]
Diacylglycerophosphoserines [GP0301]
String Representations
InChiKey (Click to copy)
OSCMYEGXWGNIHT-FTXZBQHXSA-N
InChi (Click to copy)
InChI=1S/C76H150NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-34-35-36-37-38-39-40-42-44-46-48-50-52-54-56-58-60-62-64-66-68-75(79)87-72(70-85-88(82,83)86-71-73(77)76(80)81)69-84-74(78)67-65-63-61-59-57-55-53-51-49-47-45-43-41-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h72-73H,3-71,77H2,1-2H3,(H,80,81)(H,82,83)/t72-,73+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)(=O)O