EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C42H83NO9 |
| Net Charge | 0 |
| Average Mass | 746.124 |
| Monoisotopic Mass | 745.60678 |
| SMILES | [H][C@@](O)(CCCCCCCCCCCCCCC)[C@]([H])(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)CCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C42H83NO9/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(46)41(50)43-34(33-51-42-40(49)39(48)38(47)37(32-44)52-42)35(45)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h34-40,42,44-49H,3-33H2,1-2H3,(H,43,50)/t34-,35+,36+,37+,38+,39-,40+,42+/m0/s1 |
| InChIKey | LMRASRFPQLEHDY-IRGSKFTHSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| GlcCer(d18:0/18:0(2OH[R])) (CHEBI:189686) is a glycosylceramide (CHEBI:62941) |
| Synonyms | Source |
|---|---|
| N-(2R-hydroxyoctadecanoyl)-1-beta-glucosyl-octadecasphinganine | SUBMITTER |
| N-(2R-hydroxyoctadecanoyl)-1-beta-glucosyl-sphinganine | SUBMITTER |