EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H26O3 |
| Net Charge | 0 |
| Average Mass | 302.414 |
| Monoisotopic Mass | 302.18819 |
| SMILES | [H][C@@]12C[C@H]3OC[C@@]4(CCC(=O)C=C34)[C@@]1([H])CC[C@]1(C)[C@@H](O)CC[C@@]21[H] |
| InChI | InChI=1S/C19H26O3/c1-18-6-5-14-12(13(18)2-3-17(18)21)9-16-15-8-11(20)4-7-19(14,15)10-22-16/h8,12-14,16-17,21H,2-7,9-10H2,1H3/t12-,13-,14-,16+,17-,18-,19-/m0/s1 |
| InChIKey | JGXKJMMMNKXSBZ-DTQPDNRZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6beta,19-Epoxy-17beta-hydroxyandrost-4-en-3-one (CHEBI:79592) is a steroid (CHEBI:35341) |
| Manual Xrefs | Databases |
|---|---|
| C15072 | KEGG COMPOUND |