In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02019AAQ |
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Common Name | Cer(d14:1(4E)/16:1(7Z)) |
Systematic Name | N-(7Z-hexadecenoyl)-4E-tetradecasphingenine |
Synonyms | - |
Exact Mass | |
Formula | C30H57NO3 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphingosines (ceramides) [SP0201] |
PubChem Compound ID (CID) | - |
InChIKey | AMPVAWQQWQCLLL-QUEXYZLPSA-N |
InChI | InChI=1S/C30H57NO3/c1-3-5-7-9-11-13-14-15-16-18-20-22-24-26-30(34)31-28(27-32)29 (33)25-23-21-19-17-12-10-8-6-4-2/h15-16,23,25,28-29,32-33H,3-14,17-22,24,26-27H2 ,1-2H3,(H,31,34)/b16-15-,25-23+/t28-,29+/m0/s1 |
SMILES | [C@](CO)([H])(NC(CCCCC/C=C\CCCCCCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCC |
MS Spectra | - Predict MS/MS spectrum ([M-H]-) |
Status | Active (generated by computational methods) |