CHEBI:120197 - 2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[[oxo-(propan-2-ylamino)methyl]amino]-2-oxanyl]-N-[(4-phenoxyphenyl)methyl]acetamide

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ChEBI Name 2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[[oxo-(propan-2-ylamino)methyl]amino]-2-oxanyl]-N-[(4-phenoxyphenyl)methyl]acetamide
ChEBI ID CHEBI:120197
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H33N3O5
Net Charge 0
Average Mass 455.548
Monoisotopic Mass 455.24202
InChI InChI=1S/C25H33N3O5/c1-17(2)27-25(31)28-22-13-12-21(33-23(22)16-29)14-24(30)26-15-18-8-10-20(11-9-18)32-19-6-4-3-5-7-19/h3-11,17,21-23,29H,12-16H2,1-2H3,(H,26,30)(H2,27,28,31)/t21-,22-,23+/m0/s1
InChIKey MGIGDAYWWJNGIV-RJGXRXQPSA-N
SMILES CC(C)NC(=O)N[C@H]1CC[C@H](O[C@@H]1CO)CC(=O)NCC2=CC=C(C=C2)OC3=CC=CC=C3
ChEBI Ontology
Outgoing 2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[[oxo-(propan-2-ylamino)methyl]amino]-2-oxanyl]-N-[(4-phenoxyphenyl)methyl]acetamide (CHEBI:120197) is a aromatic ether (CHEBI:35618)
Manual Xref Database
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