In-Silico Structure Database (LMISSD)
Common Name
Cer(d17:0/13:0(2OH[R]))
Systematic Name
N-(2R-hydroxydodecanoyl)-heptadecasphinganine
LM ID
LMSP02029AHP
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
499.460059
Formula
Main
Classification
Category
Main Class
Sub Class
Sphingolipids [SP]
Ceramides [SP02]
N-acylsphinganines (dihydroceramides) [SP0202]
String Representations
InChiKey (Click to copy)
QPBBQHJXNBQCIS-ZGIBFIJWSA-N
InChi (Click to copy)
InChI=1S/C30H61NO4/c1-3-5-7-9-11-13-14-15-17-18-20-22-24-28(33)27(26-32)31-30(35)29(34)25-23-21-19-16-12-10-8-6-4-2/h27-29,32-34H,3-26H2,1-2H3,(H,31,35)/t27-,28+,29+/m0/s1
SMILES (Click to copy)
[C@](CO)([H])(NC([C@H](O)CCCCCCCCCCC)=O)[C@]([H])(O)CCCCCCCCCCCCCC