CHEBI:127039 - 2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(pyridin-4-yl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-phenylphenyl)methyl]acetamide

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ChEBI Name 2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(pyridin-4-yl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-phenylphenyl)methyl]acetamide
ChEBI ID CHEBI:127039
Stars This entity has been manually annotated by a third party.
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Formula C30H33N3O5
Net Charge 0
Average Mass 515.601
Monoisotopic Mass 515.24202
InChI InChI=1S/C30H33N3O5/c34-25-18-33(30(36)24-12-14-31-15-13-24)27-11-10-26(38-28(27)20-37-19-25)16-29(35)32-17-21-6-8-23(9-7-21)22-4-2-1-3-5-22/h1-9,12-15,25-28,34H,10-11,16-20H2,(H,32,35)/t25-,26+,27-,28+/m1/s1
InChIKey LGPONOAYVPFFDU-GCFVYEKYSA-N
SMILES C1C[C@@H]2[C@H](COC[C@@H](CN2C(=O)C3=CC=NC=C3)O)O[C@@H]1CC(=O)NCC4=CC=C(C=C4)C5=CC=CC=C5
ChEBI Ontology
Outgoing 2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(pyridin-4-yl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-phenylphenyl)methyl]acetamide (CHEBI:127039) is a biphenyls (CHEBI:22888)
Manual Xref Database
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