In-Silico Structure Database (LMISSD)
Common Name
Cer(t14:0/14:1(9Z))
Systematic Name
N-(9Z-tetradecenoyl)-4R-hydroxytetradecasphinganine
LM ID
LMSP02039AAK
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
469.413109
Formula
Main
Classification
Category
Main Class
Sub Class
Sphingolipids [SP]
Ceramides [SP02]
N-acyl-4-hydroxysphinganines (phytoceramides) [SP0203]
String Representations
InChiKey (Click to copy)
LFVRCDXGXJFKNT-FQMJGCRASA-N
InChi (Click to copy)
InChI=1S/C28H55NO4/c1-3-5-7-9-11-13-14-15-17-19-21-23-27(32)29-25(24-30)28(33)26(31)22-20-18-16-12-10-8-6-4-2/h9,11,25-26,28,30-31,33H,3-8,10,12-24H2,1-2H3,(H,29,32)/b11-9-/t25-,26+,28-/m0/s1
SMILES (Click to copy)
[C@](CO)([H])(NC(CCCCCCC/C=C\CCCC)=O)[C@]([H])(O)[C@H](O)CCCCCCCCCC