EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C29H34N2O5S |
| Net Charge | 0 |
| Average Mass | 522.667 |
| Monoisotopic Mass | 522.21884 |
| SMILES | C[C@H]1CN([C@@H](C)CO)C(=O)c2ccccc2-c2ccccc2CO[C@H]1CN(C)S(=O)(=O)c1ccccc1 |
| InChI | InChI=1S/C29H34N2O5S/c1-21-17-31(22(2)19-32)29(33)27-16-10-9-15-26(27)25-14-8-7-11-23(25)20-36-28(21)18-30(3)37(34,35)24-12-5-4-6-13-24/h4-16,21-22,28,32H,17-20H2,1-3H3/t21-,22-,28-/m0/s1 |
| InChIKey | NAOMOBPLTHOCBW-VPYPWEPUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-30735 (CHEBI:119286) is a sulfonamide (CHEBI:35358) |
| Manual Xrefs | Databases |
|---|---|
| LSM-30735 | LINCS |