In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02019AAD |
---|---|
Common Name | Cer(d14:1(4E)/11:0) |
Systematic Name | N-(undecanoyl)-4E-tetradecasphingenine |
Synonyms | - |
Exact Mass | |
Formula | C25H49NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphingosines (ceramides) [SP0201] |
PubChem Compound ID (CID) | - |
InChIKey | LNPIOEWQPZDLTC-VYQUXUJXSA-N |
InChI | InChI=1S/C25H49NO3/c1-3-5-7-9-11-13-14-16-18-20-24(28)23(22-27)26-25(29)21-19-17 -15-12-10-8-6-4-2/h18,20,23-24,27-28H,3-17,19,21-22H2,1-2H3,(H,26,29)/b20-18+/t2 3-,24+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |