CHEBI:106528 - N-[(5S,6R,9R)-8-(3-fluorophenyl)sulfonyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide

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ChEBI Name N-[(5S,6R,9R)-8-(3-fluorophenyl)sulfonyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide
ChEBI ID CHEBI:106528
Stars This entity has been manually annotated by a third party.
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Formula C28H33FN4O7S
Net Charge 0
Average Mass 588.650
Monoisotopic Mass 588.20540
InChI InChI=1S/C28H33FN4O7S/c1-17-14-33(41(36,37)22-8-6-7-20(29)12-22)18(2)16-39-25-13-21(30-27(34)24-11-19(3)40-31-24)9-10-23(25)28(35)32(4)15-26(17)38-5/h6-13,17-18,26H,14-16H2,1-5H3,(H,30,34)/t17-,18-,26-/m1/s1
InChIKey ZYYGXPKBDOJORP-UYPAYLBCSA-N
SMILES C[C@@H]1CN([C@@H](COC2=C(C=CC(=C2)NC(=O)C3=NOC(=C3)C)C(=O)N(C[C@H]1OC)C)C)S(=O)(=O)C4=CC=CC(=C4)F
ChEBI Ontology
Outgoing N-[(5S,6R,9R)-8-(3-fluorophenyl)sulfonyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide (CHEBI:106528) is a azamacrocycle (CHEBI:52898)
N-[(5S,6R,9R)-8-(3-fluorophenyl)sulfonyl-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-5-methyl-3-isoxazolecarboxamide (CHEBI:106528) is a lactam (CHEBI:24995)
Manual Xref Database
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