In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02019AAK |
---|---|
Common Name | Cer(d14:1(4E)/14:1(9Z)) |
Systematic Name | N-(9Z-tetradecenoyl)-4E-tetradecasphingenine |
Synonyms | - |
Exact Mass | |
Formula | C28H53NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphingosines (ceramides) [SP0201] |
PubChem Compound ID (CID) | - |
InChIKey | KWLAAXYDSSKSMC-OXUXKYDJSA-N |
InChI | InChI=1S/C28H53NO3/c1-3-5-7-9-11-13-14-16-18-20-22-24-28(32)29-26(25-30)27(31)23 -21-19-17-15-12-10-8-6-4-2/h9,11,21,23,26-27,30-31H,3-8,10,12-20,22,24-25H2,1-2H 3,(H,29,32)/b11-9-,23-21+/t26-,27+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCC/C=C\CCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |