EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C42H81NO3 |
| Net Charge | 0 |
| Average Mass | 648.114 |
| Monoisotopic Mass | 647.62165 |
| SMILES | CCCCCCCCC/C=C/CC/C=C/[C@@H](O)[C@H](CO)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h27,29,35,37,40-41,44-45H,3-26,28,30-34,36,38-39H2,1-2H3,(H,43,46)/b29-27+,37-35+/t40-,41+/m0/s1 |
| InChIKey | ZCUCZYYSYGKQQV-VQHFJEIZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (4E,8E)-N-tetracosanoylsphinga-4,8-dienine (CHEBI:157628) is a N-(very-long-chain fatty acyl)-sphingoid base (CHEBI:144712) |
| (4E,8E)-N-tetracosanoylsphinga-4,8-dienine (CHEBI:157628) is a N-acyl-sphinga-4,8-dienine (CHEBI:195273) |
| Synonym | Source |
|---|---|
| (2S,3S,4E,8E)-N-tetracosanoyl-2-amino-1,3-octadeca-4,8-dienediol | SUBMITTER |
| UniProt Name | Source |
|---|---|
| N-tetracosanoylsphinga-(4E,8E)-dienine | UniProt |
| Citations |
|---|