In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029ATA |
---|---|
Common Name | Cer(d21:0/13:0) |
Systematic Name | N-(tridecanoyl)-heneicosasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C34H69NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | XXCLTGBRZXUGCX-JHOUSYSJSA-N |
InChI | InChI=1S/C34H69NO3/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-29-33(37)32(31 -36)35-34(38)30-28-26-24-22-14-12-10-8-6-4-2/h32-33,36-37H,3-31H2,1-2H3,(H,35,38 )/t32-,33+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCCC)=O)[C@]([H])(O)CCCCCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |