CHEBI:96592 - N-[[(2S,3R)-8-(3-hydroxy-3-methylbut-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-methoxy-N-methylacetamide

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ChEBI Name N-[[(2S,3R)-8-(3-hydroxy-3-methylbut-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-methoxy-N-methylacetamide
ChEBI ID CHEBI:96592
Stars This entity has been manually annotated by a third party.
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Formula C23H33N3O6
Net Charge 0
Average Mass 447.526
Monoisotopic Mass 447.23694
InChI InChI=1S/C23H33N3O6/c1-15-11-26(16(2)13-27)22(29)18-9-17(7-8-23(3,4)30)10-24-21(18)32-19(15)12-25(5)20(28)14-31-6/h9-10,15-16,19,27,30H,11-14H2,1-6H3/t15-,16+,19-/m1/s1
InChIKey KFBFJFZZVCOITQ-JTDSTZFVSA-N
SMILES C[C@@H]1CN(C(=O)C2=C(N=CC(=C2)C#CC(C)(C)O)O[C@@H]1CN(C)C(=O)COC)[C@@H](C)CO
ChEBI Ontology
Outgoing N-[[(2S,3R)-8-(3-hydroxy-3-methylbut-1-ynyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-2-methoxy-N-methylacetamide (CHEBI:96592) is a aromatic ether (CHEBI:35618)
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