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| Formula | C48H91NO8 |
| Net Charge | 0 |
| Average Mass | 810.255 |
| Monoisotopic Mass | 809.67447 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)C(O)C1O)[C@H](O)/C=C/CCCCCCCCCCCCC |
| InChI | InChI=1S/C48H91NO8/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-44(52)49-41(40-56-48-47(55)46(54)45(53)43(39-50)57-48)42(51)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h17-18,35,37,41-43,45-48,50-51,53-55H,3-16,19-34,36,38-40H2,1-2H3,(H,49,52)/b18-17-,37-35+/t41-,42+,43+,45+,46?,47?,48+/m0/s1 |
| InChIKey | WBOZIXHPUPAOIA-RBELZSLISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| Very Low Density Lipoprotein (NCIT:C173032) | MetaboLights (MTBLS4231) | ||
| blood plasma (BTO:0000131) | MetaboLights (MTBLS4231) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| GlcCer d42:2 (CHEBI:190675) is a glycosphingolipid (CHEBI:24402) |
| IUPAC Name |
|---|
| (Z)-N-[(E,2S,3R)-3-hydroxy-1-[(2R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadec-4-en-2-yl]tetracos-15-enamide |
| Manual Xrefs | Databases |
|---|---|
| 4881991 | ChemSpider |