In-Silico Structure Database (LMISSD)
Common Name
PS(10:0/20:4(7E,10E,13E,16E))
Systematic Name
1-decanoyl-2-(7E,10E,13E,16E-eicosatetraenoyl)-sn-glycero-3-phosphoserine
LM ID
LMGP03019ABN
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
699.411137
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoserines [GP03]
Diacylglycerophosphoserines [GP0301]
String Representations
InChiKey (Click to copy)
JTESPLOVVBZSGS-CKXHIGEMSA-N
InChi (Click to copy)
InChI=1S/C36H62NO10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-35(39)47-32(30-45-48(42,43)46-31-33(37)36(40)41)29-44-34(38)27-25-23-21-10-8-6-4-2/h7,9,12-13,15-16,18-19,32-33H,3-6,8,10-11,14,17,20-31,37H2,1-2H3,(H,40,41)(H,42,43)/b9-7+,13-12+,16-15+,19-18+/t32-,33+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCC/C=C/C/C=C/C/C=C/C/C=C/CCC)=O)COC(CCCCCCCCC)=O)(=O)O