CHEBI:129447 - (8S,9R,10S)-9-[4-(2-fluorophenyl)phenyl]-10-(hydroxymethyl)-N-(4-methoxyphenyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide

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ChEBI Name (8S,9R,10S)-9-[4-(2-fluorophenyl)phenyl]-10-(hydroxymethyl)-N-(4-methoxyphenyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide
ChEBI ID CHEBI:129447
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H32FN3O3
Net Charge 0
Average Mass 489.582
Monoisotopic Mass 489.24277
InChI InChI=1S/C29H32FN3O3/c1-36-23-14-12-22(13-15-23)31-29(35)32-16-4-5-17-33-26(18-32)28(27(33)19-34)21-10-8-20(9-11-21)24-6-2-3-7-25(24)30/h2-3,6-15,26-28,34H,4-5,16-19H2,1H3,(H,31,35)/t26-,27-,28-/m1/s1
InChIKey RFUZVCVZMIURGH-JCYYIGJDSA-N
SMILES COC1=CC=C(C=C1)NC(=O)N2CCCCN3[C@H](C2)[C@H]([C@H]3CO)C4=CC=C(C=C4)C5=CC=CC=C5F
ChEBI Ontology
Outgoing (8S,9R,10S)-9-[4-(2-fluorophenyl)phenyl]-10-(hydroxymethyl)-N-(4-methoxyphenyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:129447) is a biphenyls (CHEBI:22888)
Manual Xref Database
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