EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:122583 - N-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3-pyridinylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]benzenesulfonamide

ChEBI IDCHEBI:122583
ChEBI NameN-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3-pyridinylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]benzenesulfonamide
Stars
DownloadsMolfile
FormulaC29H36N4O5S
Net Charge0
Average Mass552.697
Monoisotopic Mass552.24064
SMILESCO[C@H]1CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2OC[C@@H](C)N(Cc2cccnc2)C[C@H]1C
InChIInChI=1S/C29H36N4O5S/c1-21-17-33(18-23-9-8-14-30-16-23)22(2)20-38-27-15-24(31-39(35,36)25-10-6-5-7-11-25)12-13-26(27)29(34)32(3)19-28(21)37-4/h5-16,21-22,28,31H,17-20H2,1-4H3/t21-,22-,28+/m1/s1
InChIKeySLSVJKSFTBBFSH-XJGOYTCSSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3-pyridinylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]benzenesulfonamide (CHEBI:122583) is a azamacrocycle (CHEBI:52898)
N-[(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3-pyridinylmethyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]benzenesulfonamide (CHEBI:122583) is a lactam (CHEBI:24995)
Manual XrefsDatabases
LSM-34026LINCS