CHEBI:107171 - (1R,5S)-6-[[5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-6-azabicyclo[3.2.1]octane

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ChEBI Name (1R,5S)-6-[[5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-6-azabicyclo[3.2.1]octane
ChEBI ID CHEBI:107171
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H22FN3O
Net Charge 0
Average Mass 315.386
Monoisotopic Mass 315.17469
InChI InChI=1S/C18H22FN3O/c1-23-15-5-6-16(17(19)8-15)18-13(9-20-21-18)11-22-10-12-3-2-4-14(22)7-12/h5-6,8-9,12,14H,2-4,7,10-11H2,1H3,(H,20,21)/t12-,14+/m1/s1
InChIKey WQLOGZZEUSRGDC-OCCSQVGLSA-N
SMILES COC1=CC(=C(C=C1)C2=C(C=NN2)CN3C[C@@H]4CCC[C@H]3C4)F
ChEBI Ontology
Outgoing (1R,5S)-6-[[5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-6-azabicyclo[3.2.1]octane (CHEBI:107171) is a pyrazoles (CHEBI:26410)
(1R,5S)-6-[[5-(2-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-6-azabicyclo[3.2.1]octane (CHEBI:107171) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-18525 LINCS
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