In-Silico Structure Database (LMISSD)
Common Name
CerP(d22:1(8E)/14:0(2OH[R]))
Systematic Name
N-(2R-hydroxytetradecanoyl)-8E-docosasphingenine-1-phosphate
LM ID
LMSP02059DCA
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
661.504642
Formula
Main
Classification
Category
Main Class
Sub Class
Sphingolipids [SP]
Ceramides [SP02]
Ceramide 1-phosphates [SP0205]
String Representations
InChiKey (Click to copy)
ANAWWBXLORBUCV-SREJGPBNSA-N
InChi (Click to copy)
InChI=1S/C36H72NO7P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-24-26-28-30-34(38)33(32-44-45(41,42)43)37-36(40)35(39)31-29-27-25-22-14-12-10-8-6-4-2/h21,23,33-35,38-39H,3-20,22,24-32H2,1-2H3,(H,37,40)(H2,41,42,43)/b23-21+/t33-,34+,35+/m0/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O)([H])(NC([C@H](O)CCCCCCCCCCCC)=O)[C@]([H])(O)CCCC/C=C/CCCCCCCCCCCCC