EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C34H41N3S |
| Net Charge | 0 |
| Average Mass | 523.790 |
| Monoisotopic Mass | 523.30212 |
| SMILES | [H]c1c([H])c([H])c2c(SC([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])N([H])c3c4c(nc5c([H])c([H])c([H])c([H])c35)C([H])([H])C([H])([H])C([H])([H])C4([H])[H])c3c(nc2c1[H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H] |
| InChI | InChI=1S/C34H41N3S/c1(3-13-23-35-33-25-15-5-9-19-29(25)36-30-20-10-6-16-26(30)33)2-4-14-24-38-34-27-17-7-11-21-31(27)37-32-22-12-8-18-28(32)34/h5,7,9,11,15,17,19,21H,1-4,6,8,10,12-14,16,18,20,22-24H2,(H,35,36) |
| InChIKey | COEYCPFFRLYNSC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[8-(1,2,3,4-tetrahydroacridin-9-ylthio)octyl]-1,2,3,4-tetrahydroacridin-9-amine (CHEBI:44271) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| N-[8-(1,2,3,4-tetrahydroacridin-9-ylsulfanyl)octyl]-1,2,3,4-tetrahydroacridin-9-amine | PDBeChem |
| N-[8-(1,2,3,4-tetrahydroacridin-9-ylthio)octyl]-1,2,3,4-tetrahydroacridin-9-amine | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| N8T | PDBeChem |