CHEBI:102568 - N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3,3,3-trifluoropropyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzodioxole-5-carboxamide

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ChEBI Name N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3,3,3-trifluoropropyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzodioxole-5-carboxamide
ChEBI ID CHEBI:102568
Stars This entity has been manually annotated by a third party.
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Formula C28H34F3N3O6
Net Charge 0
Average Mass 565.582
Monoisotopic Mass 565.23997
InChI InChI=1S/C28H34F3N3O6/c1-17-13-34(10-9-28(29,30)31)18(2)15-38-23-12-20(6-7-21(23)27(36)33(3)14-25(17)37-4)32-26(35)19-5-8-22-24(11-19)40-16-39-22/h5-8,11-12,17-18,25H,9-10,13-16H2,1-4H3,(H,32,35)/t17-,18+,25-/m1/s1
InChIKey RXVPCSLMNQSOJP-FUMQJTLXSA-N
SMILES C[C@@H]1CN([C@H](COC2=C(C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)N(C[C@H]1OC)C)C)CCC(F)(F)F
ChEBI Ontology
Outgoing N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3,3,3-trifluoropropyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzodioxole-5-carboxamide (CHEBI:102568) is a azamacrocycle (CHEBI:52898)
N-[(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-8-(3,3,3-trifluoropropyl)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1,3-benzodioxole-5-carboxamide (CHEBI:102568) is a lactam (CHEBI:24995)
Manual Xref Database
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