EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C23H31N3O5 |
| Net Charge | 0 |
| Average Mass | 429.517 |
| Monoisotopic Mass | 429.22637 |
| SMILES | CO[C@H]1CC[C@@H]2CCN(C)C(=O)CCCN(C)C(=O)c3cc(C#N)ccc3OC[C@@H]1O2 |
| InChI | InChI=1S/C23H31N3O5/c1-25-12-10-17-7-9-20(29-3)21(31-17)15-30-19-8-6-16(14-24)13-18(19)23(28)26(2)11-4-5-22(25)27/h6,8,13,17,20-21H,4-5,7,9-12,15H2,1-3H3/t17-,20+,21+/m1/s1 |
| InChIKey | ARXXSDYOSSAWCH-QMMLZNLJSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-39811 (CHEBI:128256) is a azamacrocycle (CHEBI:52898) |
| LSM-39811 (CHEBI:128256) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-39811 | LINCS |