In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029AZ4 |
---|---|
Common Name | Cer(d14:0/17:0(2OH[R])) |
Systematic Name | N-(2R-hydroxyheptadecanoyl)-tetradecasphinganine |
Synonyms | Cer(d31:0h); Cer(d14:0/17:0h) |
Exact Mass | |
Formula | C31H63NO4 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | YHEJFQVWYFLTPG-FRXPANAUSA-N |
InChI | InChI=1S/C31H63NO4/c1-3-5-7-9-11-13-14-15-16-18-20-22-24-26-30(35)31(36)32-28(27 -33)29(34)25-23-21-19-17-12-10-8-6-4-2/h28-30,33-35H,3-27H2,1-2H3,(H,32,36)/t28- ,29+,30+/m0/s1 |
SMILES | [C@](CO)([H])(NC([C@H](O)CCCCCCCCCCCCCCC)=O)[C@]([H])(O)CCCCCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |