EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H37N5O4 |
| Net Charge | 0 |
| Average Mass | 459.591 |
| Monoisotopic Mass | 459.28455 |
| SMILES | COc1ccccc1CN(C)C[C@H]1OCc2cnnn2CCCC(=O)N([C@H](C)CO)C[C@H]1C |
| InChI | InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)10-7-11-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-8-5-6-9-22(20)32-4/h5-6,8-9,12,18-19,23,30H,7,10-11,13-17H2,1-4H3/t18-,19-,23-/m1/s1 |
| InChIKey | QHTRHHVBBSPOHC-DNVFCKCGSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-9-[[(2-methoxyphenyl)methyl-methylamino]methyl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:113447) is a azamacrocycle (CHEBI:52898) |
| (8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-9-[[(2-methoxyphenyl)methyl-methylamino]methyl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:113447) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24857 | LINCS |