CHEBI:128100 - 2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(3-pyridinyl)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 IDCHEBI:128100
ChEBI Name2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(3-pyridinyl)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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DownloadsMolfile
FormulaC30H33N3O5
Net Charge0
Average Mass515.610
Monoisotopic Mass515.24202
SMILESO=C(C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2cccnc2)O1)NCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C30H33N3O5/c34-25-18-33(30(36)24-7-4-14-31-17-24)27-13-12-26(38-28(27)20-37-19-25)15-29(35)32-16-21-8-10-23(11-9-21)22-5-2-1-3-6-22/h1-11,14,17,25-28,34H,12-13,15-16,18-20H2,(H,32,35)/t25-,26+,27-,28+/m1/s1
InChIKeyYFVNJWJCKWNIAW-GCFVYEKYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(3-pyridinyl)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:128100) is a biphenyls (CHEBI:22888)
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LSM-39656LINCS