In-Silico Structure Database (LMISSD)
Common Name
PS(15:0/18:2(10E,12Z)(9OH[S]))
Systematic Name
1-pentadecanoyl-2-(9S-HODE)-sn-glycero-3-phosphoserine
LM ID
LMGP20049ALX
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
761.484302
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Oxidized glycerophospholipids [GP20]
Oxidized glycerophosphoserines [GP2004]
String Representations
InChiKey (Click to copy)
SDFANAADKCERPB-AAXXMUDWSA-N
InChi (Click to copy)
InChI=1S/C39H72NO11P/c1-3-5-7-9-11-12-13-14-15-17-21-25-29-37(42)48-31-35(32-49-52(46,47)50-33-36(40)39(44)45)51-38(43)30-26-22-18-20-24-28-34(41)27-23-19-16-10-8-6-4-2/h16,19,23,27,34-36,41H,3-15,17-18,20-22,24-26,28-33,40H2,1-2H3,(H,44,45)(H,46,47)/b19-16-,27-23+/t34-,35-,36+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCC[C@H](O)/C=C/C=C\CCCCC)=O)COC(CCCCCCCCCCCCCC)=O)(=O)O