In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02019AUU |
---|---|
Common Name | Cer(d15:2(4E,8E)/15:0) |
Systematic Name | N-(pentadecanoyl)-4E,8E-pentadecasphingadienine |
Synonyms | - |
Exact Mass | |
Formula | C30H57NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphingosines (ceramides) [SP0201] |
PubChem Compound ID (CID) | - |
InChIKey | IBNWYCGSQLELLG-HGEQXHNXSA-N |
InChI | InChI=1S/C30H57NO3/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-30(34)31-28(27-32)29(33 )25-23-21-19-17-14-12-10-8-6-4-2/h14,17,23,25,28-29,32-33H,3-13,15-16,18-22,24,2 6-27H2,1-2H3,(H,31,34)/b17-14+,25-23+/t28-,29+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C/CCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |