In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029AXA |
---|---|
Common Name | Cer(d22:0/20:0) |
Systematic Name | N-(eicosanoyl)-docosasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C42H85NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | FVMBAAOJUQMJDQ-WVILEFPPSA-N |
InChI | InChI=1S/C42H85NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-41(45)40 (39-44)43-42(46)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h40-41,44-4 5H,3-39H2,1-2H3,(H,43,46)/t40-,41+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCCCCCCCCCC)=O)[C@]([H])(O)CCCCCCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |