EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:2903 - Atalaphylline
| Formula | C23H25NO4 |
| Net Charge | 0 |
| Average Mass | 379.456 |
| Monoisotopic Mass | 379.17836 |
| SMILES | CC(C)=CCc1c(O)c(CC=C(C)C)c2nc3c(O)cccc3c(=O)c2c1O |
| InChI | InChI=1S/C23H25NO4/c1-12(2)8-10-15-20-18(23(28)16(21(15)26)11-9-13(3)4)22(27)14-6-5-7-17(25)19(14)24-20/h5-9,25-26,28H,10-11H2,1-4H3,(H,24,27) |
| InChIKey | GLXYKTASIIUSRC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Atalaphylline (CHEBI:2903) has functional parent acridone (CHEBI:50756) |
| Atalaphylline (CHEBI:2903) is a acridines (CHEBI:22213) |
| Synonym | Source |
|---|---|
| Atalaphylline | KEGG COMPOUND |