CHEBI:98077 - 2-[(3R,6aS,8R,10aS)-3-hydroxy-1-(pyridine-3-carbonyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide

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ChEBI Name 2-[(3R,6aS,8R,10aS)-3-hydroxy-1-(pyridine-3-carbonyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
ChEBI ID CHEBI:98077
Stars This entity has been manually annotated by a third party.
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Formula C29H31N3O5
Net Charge 0
Average Mass 501.575
Monoisotopic Mass 501.22637
InChI InChI=1S/C29H31N3O5/c33-24-17-32(29(35)22-7-4-14-30-16-22)26-13-12-25(37-27(26)19-36-18-24)15-28(34)31-23-10-8-21(9-11-23)20-5-2-1-3-6-20/h1-11,14,16,24-27,33H,12-13,15,17-19H2,(H,31,34)/t24-,25-,26+,27-/m1/s1
InChIKey WTHWQCPYZWPYSX-JVYGEBFASA-N
SMILES C1C[C@H]2[C@@H](COC[C@@H](CN2C(=O)C3=CN=CC=C3)O)O[C@H]1CC(=O)NC4=CC=C(C=C4)C5=CC=CC=C5
ChEBI Ontology
Outgoing 2-[(3R,6aS,8R,10aS)-3-hydroxy-1-(pyridine-3-carbonyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide (CHEBI:98077) is a biphenyls (CHEBI:22888)
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