In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02019AAH |
---|---|
Common Name | Cer(d14:1(4E)/13:0) |
Systematic Name | N-(tridecanoyl)-4E-tetradecasphingenine |
Synonyms | - |
Exact Mass | |
Formula | C27H53NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphingosines (ceramides) [SP0201] |
PubChem Compound ID (CID) | - |
InChIKey | LVZKYCXPGIKDAN-XQAXIDAFSA-N |
InChI | InChI=1S/C27H53NO3/c1-3-5-7-9-11-13-15-17-19-21-23-27(31)28-25(24-29)26(30)22-20 -18-16-14-12-10-8-6-4-2/h20,22,25-26,29-30H,3-19,21,23-24H2,1-2H3,(H,28,31)/b22- 20+/t25-,26+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |