EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H36N4O5 |
| Net Charge | 0 |
| Average Mass | 496.608 |
| Monoisotopic Mass | 496.26857 |
| SMILES | CCCN1[C@@H]2c3ccc(-c4ccc(C(=O)N(C)C)cc4)c(=O)n3C[C@@H]2[C@@H](CO)[C@@H]1C(=O)NCCOC |
| InChI | InChI=1S/C27H36N4O5/c1-5-13-30-23-20(21(16-32)24(30)25(33)28-12-14-36-4)15-31-22(23)11-10-19(27(31)35)17-6-8-18(9-7-17)26(34)29(2)3/h6-11,20-21,23-24,32H,5,12-16H2,1-4H3,(H,28,33)/t20-,21-,23+,24-/m1/s1 |
| InChIKey | MMSAETDDPZXZRS-CJTFWIGWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2R,3R,3aS,9bS)-7-[4-(dimethylcarbamoyl)phenyl]-3-(hydroxymethyl)-N-(2-methoxyethyl)-6-oxo-1-propyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide (CHEBI:97833) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-9212 | LINCS |