EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C37H72O2 |
| Net Charge | 0 |
| Average Mass | 548.981 |
| Monoisotopic Mass | 548.55323 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[C@H]1CCC(=O)O1 |
| InChI | InChI=1S/C37H72O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-36-34-35-37(38)39-36/h36H,2-35H2,1H3/t36-/m0/s1 |
| InChIKey | QDMSVBSGCFFYNT-BHVANESWSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Actinomadura (ncbitaxon:1988) | - | DOI (10.1007/s10600-013-0567-3) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Actinomiaolone (CHEBI:220988) is a γ-lactone (CHEBI:37581) |
| IUPAC Name |
|---|
| (5S)-5-tritriacontyloxolan-2-one |
| Manual Xrefs | Databases |
|---|---|
| 78441390 | ChemSpider |