EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H24Cl2O7 |
| Net Charge | 0 |
| Average Mass | 435.300 |
| Monoisotopic Mass | 434.08991 |
| SMILES | [H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](OC(=O)[C@](C)(O)CCl)CC(=C)[C@]1([H])C[C@@H](O)[C@](O)(CCl)[C@]21[H] |
| InChI | InChI=1S/C19H24Cl2O7/c1-8-4-11(27-17(24)18(3,25)6-20)13-9(2)16(23)28-15(13)14-10(8)5-12(22)19(14,26)7-21/h10-15,22,25-26H,1-2,4-7H2,3H3/t10-,11-,12+,13+,14-,15-,18+,19+/m0/s1 |
| InChIKey | NUVAJKJDTZTFLK-KPSOQAITSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Chlorohyssopifolin A (CHEBI:3627) is a sesquiterpene lactone (CHEBI:37667) |
| Synonym | Source |
|---|---|
| Chlorohyssopifolin A | KEGG COMPOUND |