EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H33NO5 |
| Net Charge | 0 |
| Average Mass | 415.530 |
| Monoisotopic Mass | 415.23587 |
| SMILES | COC12C=C(C(=O)C3C(C)C(C)=CC4(C)CC(C)CCC34)C(=O)N1CCC2C(=O)O |
| InChI | InChI=1S/C24H33NO5/c1-13-6-7-17-19(15(3)14(2)11-23(17,4)10-13)20(26)16-12-24(30-5)18(22(28)29)8-9-25(24)21(16)27/h11-13,15,17-19H,6-10H2,1-5H3,(H,28,29) |
| InChIKey | GWQCDLPQPNXPCV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| CJ-16,367 (CHEBI:200455) is a pyrrolizines (CHEBI:38522) |
| IUPAC Name |
|---|
| 6-(2,3,4a,6-tetramethyl-2,5,6,7,8,8a-hexahydro-1H-naphthalene-1-carbonyl)-8-methoxy-5-oxo-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 8107310 | ChemSpider |