EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C28H33F2N7O2S |
| Net Charge | 0 |
| Average Mass | 569.682 |
| Monoisotopic Mass | 569.23845 |
| SMILES | CCCS(=O)(=O)Nc1ccc(F)c(-n2cc(-c3cncnc3)c3nc(N(C)C4CCN(CC)CC4)ccc32)c1F |
| InChI | InChI=1S/C28H33F2N7O2S/c1-4-14-40(38,39)34-23-7-6-22(29)28(26(23)30)37-17-21(19-15-31-18-32-16-19)27-24(37)8-9-25(33-27)35(3)20-10-12-36(5-2)13-11-20/h6-9,15-18,20,34H,4-5,10-14H2,1-3H3 |
| InChIKey | AEJACXAFHXBVHF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| xp-102 (CHEBI:756646) is a sulfonamide (CHEBI:35358) |
| Synonyms | Source |
|---|---|
| BI 882370 | ChEMBL |
| BI-882370 | ChEMBL |
| Xp 102 | ChEMBL |
| Xp-102 | ChEMBL |
| Citations |
|---|