EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C26H30N4O5S |
| Net Charge | 0 |
| Average Mass | 510.616 |
| Monoisotopic Mass | 510.19369 |
| SMILES | CCS(=O)(=O)N1Cc2cc(C(=O)NCCOC)nc(-c3cccc(-c4ccncc4)c3)c2[C@H]1CCO |
| InChI | InChI=1S/C26H30N4O5S/c1-3-36(33,34)30-17-21-16-22(26(32)28-12-14-35-2)29-25(24(21)23(30)9-13-31)20-6-4-5-19(15-20)18-7-10-27-11-8-18/h4-8,10-11,15-16,23,31H,3,9,12-14,17H2,1-2H3,(H,28,32)/t23-/m1/s1 |
| InChIKey | HISLUEZGKSFRIL-HSZRJFAPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (3R)-2-ethylsulfonyl-3-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-(3-pyridin-4-ylphenyl)-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide (CHEBI:130958) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-42506 | LINCS |