In-Silico Structure Database (LMISSD)
Common Name
PI-Cer(d14:0/15:1(9Z))
Systematic Name
N-(9Z-pentadecenoyl)-tetradecasphinganine-1-phospho-(1'-myo-inositol)
LM ID
LMSP03039AAN
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
709.453002
Formula
Main
Classification
Category
Main Class
Sub Class
Sphingolipids [SP]
Phosphosphingolipids [SP03]
Ceramide phosphoinositols [SP0303]
String Representations
InChiKey (Click to copy)
TZFWZXJIZDJGRA-SSUKJKEWSA-N
InChi (Click to copy)
InChI=1S/C35H68NO11P/c1-3-5-7-9-11-13-14-15-17-19-21-23-25-29(38)36-27(28(37)24-22-20-18-16-12-10-8-6-4-2)26-46-48(44,45)47-35-33(42)31(40)30(39)32(41)34(35)43/h11,13,27-28,30-35,37,39-43H,3-10,12,14-26H2,1-2H3,(H,36,38)(H,44,45)/b13-11-/t27-,28+,30?,31+,32?,33?,34?,35+/m0/s1
SMILES (Click to copy)
[C@](COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)([H])(NC(CCCCCCC/C=C\CCCCC)=O)[C@]([H])(O)CCCCCCCCCCC