In-Silico Structure Database (LMISSD)
Common Name
PS(O-22:0/25:0)
Systematic Name
1-docosyl-2-pentacosanoyl-sn-glycero-3-phosphoserine
LM ID
LMGP03029A51
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
931.760522
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoserines [GP03]
1-alkyl,2-acylglycerophosphoserines [GP0302]
String Representations
InChiKey (Click to copy)
UBBPEOGRGZMQRQ-KVCIEARHSA-N
InChi (Click to copy)
InChI=1S/C53H106NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-27-29-31-33-35-37-39-41-43-45-52(55)63-50(48-61-64(58,59)62-49-51(54)53(56)57)47-60-46-44-42-40-38-36-34-32-30-28-24-22-20-18-16-14-12-10-8-6-4-2/h50-51H,3-49,54H2,1-2H3,(H,56,57)(H,58,59)/t50-,51+/m1/s1
SMILES (Click to copy)
C(O)(=O)[C@@]([H])(N)COP(OC[C@]([H])(OC(CCCCCCCCCCCCCCCCCCCCCCCC)=O)COCCCCCCCCCCCCCCCCCCCCCC)(=O)O