CHEBI:102470 - 2,2,2-trifluoro-N-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide

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ChEBI Name 2,2,2-trifluoro-N-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
ChEBI ID CHEBI:102470
Stars This entity has been manually annotated by a third party.
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Download Molfile XML SDF
Formula C19H28F3N3O5S
Net Charge 0
Average Mass 467.505
Monoisotopic Mass 467.17018
InChI InChI=1S/C19H28F3N3O5S/c1-12-8-23-13(2)10-30-16-7-14(24-31(27,28)11-19(20,21)22)5-6-15(16)18(26)25(3)9-17(12)29-4/h5-7,12-13,17,23-24H,8-11H2,1-4H3/t12-,13+,17-/m0/s1
InChIKey BGDCTPQGAPJUMB-AHIWAGSCSA-N
SMILES C[C@H]1CN[C@@H](COC2=C(C=CC(=C2)NS(=O)(=O)CC(F)(F)F)C(=O)N(C[C@@H]1OC)C)C
ChEBI Ontology
Outgoing 2,2,2-trifluoro-N-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide (CHEBI:102470) is a azamacrocycle (CHEBI:52898)
2,2,2-trifluoro-N-[(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide (CHEBI:102470) is a lactam (CHEBI:24995)
Manual Xref Database
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