In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029AC7 |
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Common Name | Cer(d15:0/20:1(13Z)) |
Systematic Name | N-(13Z-eicosenoyl)-pentadecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C35H69NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | NKNDQGQDYHGILZ-RMXHKZMYSA-N |
InChI | InChI=1S/C35H69NO3/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-29-31-35(39)36 -33(32-37)34(38)30-28-26-24-22-14-12-10-8-6-4-2/h13,15,33-34,37-38H,3-12,14,16-3 2H2,1-2H3,(H,36,39)/b15-13-/t33-,34+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCC/C=C\CCCCCC)=O)[C@]([H])(O)CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |