CHEBI:100797 - N-[(4R,7R,8S)-8-methoxy-4,7,10-trimethyl-5-(3-methylphenyl)sulfonyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide

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ChEBI Name N-[(4R,7R,8S)-8-methoxy-4,7,10-trimethyl-5-(3-methylphenyl)sulfonyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide
ChEBI ID CHEBI:100797
Stars This entity has been manually annotated by a third party.
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Formula C29H36N4O7S
Net Charge 0
Average Mass 584.686
Monoisotopic Mass 584.23047
InChI InChI=1S/C29H36N4O7S/c1-18-8-7-9-23(12-18)41(36,37)33-15-19(2)27(38-6)16-32(5)29(35)24-14-22(10-11-26(24)39-17-20(33)3)30-28(34)25-13-21(4)40-31-25/h7-14,19-20,27H,15-17H2,1-6H3,(H,30,34)/t19-,20-,27-/m1/s1
InChIKey JQKUTVGMEZZDSF-SEXOINJZSA-N
SMILES C[C@@H]1CN([C@@H](COC2=C(C=C(C=C2)NC(=O)C3=NOC(=C3)C)C(=O)N(C[C@H]1OC)C)C)S(=O)(=O)C4=CC=CC(=C4)C
ChEBI Ontology
Outgoing N-[(4R,7R,8S)-8-methoxy-4,7,10-trimethyl-5-(3-methylphenyl)sulfonyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide (CHEBI:100797) is a azamacrocycle (CHEBI:52898)
N-[(4R,7R,8S)-8-methoxy-4,7,10-trimethyl-5-(3-methylphenyl)sulfonyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide (CHEBI:100797) is a lactam (CHEBI:24995)
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