In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029AAB |
---|---|
Common Name | Cer(d14:0/20:1(13Z)) |
Systematic Name | N-(13Z-eicosenoyl)-tetradecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C34H67NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | CDFSZDMLLFFSME-VAKSJLAESA-N |
InChI | InChI=1S/C34H67NO3/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-24-26-28-30-34(38)35 -32(31-36)33(37)29-27-25-23-21-12-10-8-6-4-2/h13-14,32-33,36-37H,3-12,15-31H2,1- 2H3,(H,35,38)/b14-13-/t32-,33+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCC/C=C\CCCCCC)=O)[C@]([H])(O)CCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |