EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H15ClO3 |
| Net Charge | 0 |
| Average Mass | 278.735 |
| Monoisotopic Mass | 278.07097 |
| SMILES | CC(C)Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3 |
| InChI | InChI=1S/C15H15ClO3/c1-8(2)18-14-7-13-11(6-12(14)16)9-4-3-5-10(9)15(17)19-13/h6-8H,3-5H2,1-2H3 |
| InChIKey | AXKFCVCCISFWBQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 8-chloro-7-propan-2-yloxy-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-4-one (CHEBI:108494) is a coumarins (CHEBI:23403) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19870 | LINCS |