In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02019B4Q |
---|---|
Common Name | Cer(d20:1(8E)/10:0(2OH[R])) |
Systematic Name | N-(2R-hydroxydecanoyl)-4E-eicosasphingenine |
Synonyms | Cer(d30:1h); Cer(d20:1/10:0h) |
Exact Mass | |
Formula | C30H59NO4 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphingosines (ceramides) [SP0201] |
PubChem Compound ID (CID) | - |
InChIKey | MXFPVXHPNMJHQG-SRZNSZEISA-N |
InChI | InChI=1S/C30H59NO4/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-22-24-28(33)27(26-32 )31-30(35)29(34)25-23-20-10-8-6-4-2/h17-18,27-29,32-34H,3-16,19-26H2,1-2H3,(H,31 ,35)/b18-17+/t27-,28+,29+/m0/s1 |
SMILES | [C@](CO)([H])(NC([C@H](O)CCCCCCCC)=O)[C@]([H])(O)CCCC/C=C/CCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |