In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029AKP |
---|---|
Common Name | Cer(d18:0/14:1(9Z)) |
Systematic Name | N-(9Z-tetradecenoyl)-sphinganine |
Synonyms | - |
Exact Mass | |
Formula | C32H63NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | CYBYQXACOZOWHU-XWQVIGHNSA-N |
InChI | InChI=1S/C32H63NO3/c1-3-5-7-9-11-13-15-16-18-19-21-23-25-27-31(35)30(29-34)33-32 (36)28-26-24-22-20-17-14-12-10-8-6-4-2/h10,12,30-31,34-35H,3-9,11,13-29H2,1-2H3, (H,33,36)/b12-10-/t30-,31+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCC/C=C\CCCC)=O)[C@]([H])(O)CCCCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |