In-Silico Structure Database (LMISSD)
Common Name
Cer(t14:0/19:0(2OH[R]))
Systematic Name
N-(2R-hydroxynonadecanoyl)-4R-hydroxytetradecasphinganine
LM ID
LMSP02039ABI
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
557.501924
Formula
Main
Classification
Category
Main Class
Sub Class
Sphingolipids [SP]
Ceramides [SP02]
N-acyl-4-hydroxysphinganines (phytoceramides) [SP0203]
String Representations
InChiKey (Click to copy)
HNYMGPOQSLMXCW-BVEPWEIPSA-N
InChi (Click to copy)
InChI=1S/C33H67NO5/c1-3-5-7-9-11-13-14-15-16-17-18-19-21-23-25-27-31(37)33(39)34-29(28-35)32(38)30(36)26-24-22-20-12-10-8-6-4-2/h29-32,35-38H,3-28H2,1-2H3,(H,34,39)/t29-,30+,31+,32-/m0/s1
SMILES (Click to copy)
[C@](CO)([H])(NC([C@H](O)CCCCCCCCCCCCCCCCC)=O)[C@]([H])(O)[C@H](O)CCCCCCCCCC