EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:111963 - N-[(4R,7S,8S)-8-methoxy-5-(2-methoxy-1-oxoethyl)-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide

ChEBI IDCHEBI:111963
ChEBI NameN-[(4R,7S,8S)-8-methoxy-5-(2-methoxy-1-oxoethyl)-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
Stars
DownloadsMolfile
FormulaC22H35N3O7S
Net Charge0
Average Mass485.603
Monoisotopic Mass485.21957
SMILESCCS(=O)(=O)Nc1ccc2c(c1)C(=O)N(C)C[C@@H](OC)[C@@H](C)CN(C(=O)COC)[C@H](C)CO2
InChIInChI=1S/C22H35N3O7S/c1-7-33(28,29)23-17-8-9-19-18(10-17)22(27)24(4)12-20(31-6)15(2)11-25(16(3)13-32-19)21(26)14-30-5/h8-10,15-16,20,23H,7,11-14H2,1-6H3/t15-,16+,20+/m0/s1
InChIKeyKQGPOQXVBLOFLH-RZQQEMMASA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(4R,7S,8S)-8-methoxy-5-(2-methoxy-1-oxoethyl)-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide (CHEBI:111963) is a azamacrocycle (CHEBI:52898)
N-[(4R,7S,8S)-8-methoxy-5-(2-methoxy-1-oxoethyl)-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide (CHEBI:111963) is a lactam (CHEBI:24995)
Manual XrefsDatabases
LSM-23376LINCS