In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029ABO |
---|---|
Common Name | Cer(d14:0/37:0) |
Systematic Name | N-(heptatriacontanoyl)-tetradecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C51H103NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | LQEVOUBWGDPUMK-LOYCUKJKSA-N |
InChI | InChI=1S/C51H103NO3/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-2 8-29-30-31-32-33-34-35-36-37-39-41-43-45-47-51(55)52-49(48-53)50(54)46-44-42-40- 38-12-10-8-6-4-2/h49-50,53-54H,3-48H2,1-2H3,(H,52,55)/t49-,50+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)=O)[C@]([H])(O)CCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |