EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C29H24N2O4S |
| Net Charge | 0 |
| Average Mass | 496.588 |
| Monoisotopic Mass | 496.14568 |
| SMILES | COc1ccc(OC)c(C2C3=C(N=c4sc(=Cc5cccc(O)c5)c(=O)n42)c2ccccc2CC3)c1 |
| InChI | InChI=1S/C29H24N2O4S/c1-34-20-11-13-24(35-2)23(16-20)27-22-12-10-18-7-3-4-9-21(18)26(22)30-29-31(27)28(33)25(36-29)15-17-6-5-8-19(32)14-17/h3-9,11,13-16,27,32H,10,12H2,1-2H3 |
| InChIKey | CLHCQUDCQDMFRG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-24543 (CHEBI:113132) is a naphthalenes (CHEBI:25477) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24543 | LINCS |