In-Silico Structure database (LMISSD)
| |
LM ID | LMSP02019BEW |
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Common Name | Cer(d17:2(4E,8E)/13:0(2OH[R])) |
Systematic Name | N-(2R-hydroxydodecanoyl)-4E,8E-heptadecasphingadienine |
Synonyms | Cer(d30:2h); Cer(d17:2/13:0h) |
Exact Mass | |
Formula | C30H57NO4 |
Category | Sphingolipids [SP] |
Main Class | Ceramides [SP02] |
Sub Class | N-acylsphingosines (ceramides) [SP0201] |
PubChem Compound ID (CID) | - |
InChIKey | NLXDREKQKRMFBO-RXLZVWHNSA-N |
InChI | InChI=1S/C30H57NO4/c1-3-5-7-9-11-13-14-15-17-18-20-22-24-28(33)27(26-32)31-30(35 )29(34)25-23-21-19-16-12-10-8-6-4-2/h15,17,22,24,27-29,32-34H,3-14,16,18-21,23,2 5-26H2,1-2H3,(H,31,35)/b17-15+,24-22+/t27-,28+,29+/m0/s1 |
SMILES | [C@](CO)([H])(NC([C@H](O)CCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C/CCCCCCCC |
MS Spectra | - |
Status | Active (generated by computational methods) |