In-Silico Structure Database (LMISSD)
Common Name
CerP(d15:2(4E,8E)/24:4(5Z,8Z,11Z,14Z))
Systematic Name
N-(5Z,8Z,11Z,14Z-tetracosatetraenoyl)-4E,8E-pentadecasphingadienine-1-phosphate
LM ID
LMSP02059A2K
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
677.478427
Formula
Main
Classification
Category
Main Class
Sub Class
Sphingolipids [SP]
Ceramides [SP02]
Ceramide 1-phosphates [SP0205]
String Representations
InChiKey (Click to copy)
JUTMQAPOSZIESZ-KCDSHGCWSA-N
InChi (Click to copy)
InChI=1S/C39H68NO6P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-25-27-29-31-33-35-39(42)40-37(36-46-47(43,44)45)38(41)34-32-30-28-26-14-12-10-8-6-4-2/h14,17-18,20-21,23-24,26-27,29,32,34,37-38,41H,3-13,15-16,19,22,25,28,30-31,33,35-36H2,1-2H3,(H,40,42)(H2,43,44,45)/b18-17-,21-20-,24-23-,26-14+,29-27-,34-32+/t37-,38+/m0/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(NC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C/CCCCCC