EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C35H51N3O7S |
| Net Charge | 0 |
| Average Mass | 657.874 |
| Monoisotopic Mass | 657.34477 |
| SMILES | C[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2O[C@@H](C)CCCCO[C@@H]1CN(C)C(=O)C1CCCCC1 |
| InChI | InChI=1S/C35H51N3O7S/c1-25-22-38(26(2)24-39)35(41)31-21-29(36-46(42,43)30-16-9-6-10-17-30)18-19-32(31)45-27(3)13-11-12-20-44-33(25)23-37(4)34(40)28-14-7-5-8-15-28/h6,9-10,16-19,21,25-28,33,36,39H,5,7-8,11-15,20,22-24H2,1-4H3/t25-,26+,27+,33-/m1/s1 |
| InChIKey | LBSWGOFICLFHSX-HYHRRZRMSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[(3S,9S,10R)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide (CHEBI:129081) is a azamacrocycle (CHEBI:52898) |
| N-[[(3S,9S,10R)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide (CHEBI:129081) is a lactam (CHEBI:24995) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40633 | LINCS |