EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C46H87NO9 |
| Net Charge | 0 |
| Average Mass | 798.200 |
| Monoisotopic Mass | 797.63808 |
| SMILES | CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CC/C=C\CCCCC1CC1CCCCCCCCCC |
| InChI | InChI=1S/C46H87NO9/c1-3-5-7-9-11-13-14-15-16-18-23-27-31-39(49)42(51)38(35-55-46-45(54)44(53)43(52)40(34-48)56-46)47-41(50)32-28-24-20-19-22-26-30-37-33-36(37)29-25-21-17-12-10-8-6-4-2/h20,24,36-40,42-46,48-49,51-54H,3-19,21-23,25-35H2,1-2H3,(H,47,50)/b24-20-/t36?,37?,38-,39+,40+,42-,43-,44-,45+,46-/m0/s1 |
| InChIKey | MUTIAULHGSSWRA-FIVBKBASSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| α-D-galactosyl-N-[(4Z)-9-(2-decylcyclopropyl)non-4-enoyl]phytosphingosine (CHEBI:75222) is a D-galactosyl-N-acylphytosphingosine (CHEBI:75225) |
| Synonym | Source |
|---|---|
| EF77 | ChEBI |
| Citations |
|---|