EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H28O |
| Net Charge | 0 |
| Average Mass | 284.443 |
| Monoisotopic Mass | 284.21402 |
| SMILES | [H][C@@]12CC=C3CCCC[C@]3([H])[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@@]1(O)C#C |
| InChI | InChI=1S/C20H28O/c1-3-20(21)13-11-18-17-9-8-14-6-4-5-7-15(14)16(17)10-12-19(18,20)2/h1,8,15-18,21H,4-7,9-13H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1 |
| InChIKey | HSYWFJBHXIUUCZ-XGXHKTLJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cingestol (CHEBI:750625) has parent hydride estrane (CHEBI:23966) |
| cingestol (CHEBI:750625) is a steroid (CHEBI:35341) |
| INN | Source |
|---|---|
| cingestol | WHO MedNet |
| Citations |
|---|