EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:110554 - N-[(5R,6R,9S)-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]methanesulfonamide

ChEBI IDCHEBI:110554
ChEBI NameN-[(5R,6R,9S)-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]methanesulfonamide
Stars
DownloadsMolfile
FormulaC24H34N4O5S
Net Charge0
Average Mass490.626
Monoisotopic Mass490.22499
SMILESCO[C@H]1CN(C)C(=O)c2ccc(NS(C)(=O)=O)cc2OC[C@H](C)N(Cc2cccnc2)C[C@H]1C
InChIInChI=1S/C24H34N4O5S/c1-17-13-28(14-19-7-6-10-25-12-19)18(2)16-33-22-11-20(26-34(5,30)31)8-9-21(22)24(29)27(3)15-23(17)32-4/h6-12,17-18,23,26H,13-16H2,1-5H3/t17-,18+,23+/m1/s1
InChIKeyOOYNITMNEHZMFB-STSQHVNTSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(5R,6R,9S)-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]methanesulfonamide (CHEBI:110554) is a azamacrocycle (CHEBI:52898)
N-[(5R,6R,9S)-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]methanesulfonamide (CHEBI:110554) is a lactam (CHEBI:24995)
Manual XrefsDatabases
LSM-21999LINCS