EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H48N4O5 |
| Net Charge | 0 |
| Average Mass | 520.715 |
| Monoisotopic Mass | 520.36247 |
| SMILES | CNC[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)CCCN(C)C)cc2C(=O)N([C@H](C)CO)C[C@@H]1C |
| InChI | InChI=1S/C28H48N4O5/c1-20-18-32(21(2)19-33)28(35)24-16-23(30-27(34)11-9-14-31(5)6)12-13-25(24)37-22(3)10-7-8-15-36-26(20)17-29-4/h12-13,16,20-22,26,29,33H,7-11,14-15,17-19H2,1-6H3,(H,30,34)/t20-,21+,22-,26+/m0/s1 |
| InChIKey | SBFFLWUBRLNFSF-IMIIHFCZSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-(dimethylamino)-N-[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]butanamide (CHEBI:98626) is a azamacrocycle (CHEBI:52898) |
| 4-(dimethylamino)-N-[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-(methylaminomethyl)-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]butanamide (CHEBI:98626) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-10005 | LINCS |