In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02029AFT |
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Common Name | Cer(d16:0/18:4(6Z,9Z,12Z,15Z)) |
Systematic Name | N-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-hexadecasphinganine |
Synonyms | - |
Exact Mass | |
Formula | C34H61NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphinganines (dihydroceramides) [SP0202] |
PubChem Compound ID (CID) | - |
InChIKey | YSUSYCBQKQUBMH-DAAZXKPUSA-N |
InChI | InChI=1S/C34H61NO3/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-30-34(38)35-32(31 -36)33(37)29-27-25-23-21-19-14-12-10-8-6-4-2/h5,7,11,13,16-17,20,22,32-33,36-37H ,3-4,6,8-10,12,14-15,18-19,21,23-31H2,1-2H3,(H,35,38)/b7-5-,13-11-,17-16-,22-20- /t32-,33+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O)[C@]([H])(O)CCCCCCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |