In-Silico Structure Database (LMISSD)
Common Name
PS(P-16:0/26:0)
Systematic Name
1-(1Z-hexadecenyl)-2-hexacosanoyl-sn-glycero-3-phosphoserine
LM ID
LMGP03039AB3
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
859.666622
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoserines [GP03]
1-(1Z-alkenyl),2-acylglycerophosphoserines [GP0303]
String Representations
InChiKey (Click to copy)
AYAKBDLKWARVNF-LTXWKCGFSA-N
InChi (Click to copy)
InChI=1S/C48H94NO9P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-47(50)58-45(43-56-59(53,54)57-44-46(49)48(51)52)42-55-41-39-37-35-33-31-29-18-16-14-12-10-8-6-4-2/h39,41,45-46H,3-38,40,42-44,49H2,1-2H3,(H,51,52)(H,53,54)/b41-39-/t45-,46+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCCC)=O)CO/C=C\CCCCCCCCCCCCCC)(=O)O