In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02039AGF |
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Common Name | Cer(t16:0/15:1(9Z)) |
Systematic Name | N-(9Z-pentadecenoyl)-4R-hydroxyhexadecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C31H61NO4 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acyl-4-hydroxysphinganines (phytoceramides) [SP0203] |
PubChem Compound ID (CID) | - |
InChIKey | FHAJKBINLAYKAG-JRZFMNAHSA-N |
InChI | InChI=1S/C31H61NO4/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-30(35)32-28(27-33)31(36 )29(34)25-23-21-19-17-14-12-10-8-6-4-2/h11,13,28-29,31,33-34,36H,3-10,12,14-27H2 ,1-2H3,(H,32,35)/b13-11-/t28-,29+,31-/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCC/C=C\CCCCC)=O)[C@]([H])(O)[C@H](O)CCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |