CHEBI:100544 - N-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3,5-dimethyl-4-isoxazolesulfonamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3,5-dimethyl-4-isoxazolesulfonamide
ChEBI ID CHEBI:100544
Stars This entity has been manually annotated by a third party.
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Formula C22H32N4O6S
Net Charge 0
Average Mass 480.580
Monoisotopic Mass 480.20426
InChI InChI=1S/C22H32N4O6S/c1-13-10-23-14(2)12-31-19-8-7-17(9-18(19)22(27)26(5)11-20(13)30-6)25-33(28,29)21-15(3)24-32-16(21)4/h7-9,13-14,20,23,25H,10-12H2,1-6H3/t13-,14+,20-/m1/s1
InChIKey LINNEEFEDHMFDS-LAPQFRIASA-N
SMILES C[C@@H]1CN[C@H](COC2=C(C=C(C=C2)NS(=O)(=O)C3=C(ON=C3C)C)C(=O)N(C[C@H]1OC)C)C
ChEBI Ontology
Outgoing N-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3,5-dimethyl-4-isoxazolesulfonamide (CHEBI:100544) is a azamacrocycle (CHEBI:52898)
N-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3,5-dimethyl-4-isoxazolesulfonamide (CHEBI:100544) is a lactam (CHEBI:24995)
Manual Xref Database
LSM-11918 LINCS
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