In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02039AHX |
---|---|
Common Name | Cer(t16:0/22:0) |
Systematic Name | N-(docosanoyl)-4R-hydroxyhexadecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C38H77NO4 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acyl-4-hydroxysphinganines (phytoceramides) [SP0203] |
PubChem Compound ID (CID) | - |
InChIKey | GWCLHZCUEHYHNC-BEAALGTASA-N |
InChI | InChI=1S/C38H77NO4/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-37 (42)39-35(34-40)38(43)36(41)32-30-28-26-24-14-12-10-8-6-4-2/h35-36,38,40-41,43H, 3-34H2,1-2H3,(H,39,42)/t35-,36+,38-/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCCCCCCCCCCCC)=O)[C@]([H])(O)[C@H](O)CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |