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CHEBI:129800 - 4-[4-[(6R,7R,8R)-4-[cyclohexyl(oxo)methyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octan-7-yl]phenyl]benzonitrile

ChEBI IDCHEBI:129800
ChEBI Name4-[4-[(6R,7R,8R)-4-[cyclohexyl(oxo)methyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octan-7-yl]phenyl]benzonitrile
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DownloadsMolfile
FormulaC27H29N3O3
Net Charge0
Average Mass443.547
Monoisotopic Mass443.22089
SMILESN#Cc1ccc(-c2ccc([C@H]3[C@H](CO)N4C(=O)CN(C(=O)C5CCCCC5)C[C@@H]34)cc2)cc1
InChIInChI=1S/C27H29N3O3/c28-14-18-6-8-19(9-7-18)20-10-12-21(13-11-20)26-23-15-29(16-25(32)30(23)24(26)17-31)27(33)22-4-2-1-3-5-22/h6-13,22-24,26,31H,1-5,15-17H2/t23-,24-,26+/m0/s1
InChIKeyCDFZCHJOWIFRLR-KYPHJKQUSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[4-[(6R,7R,8R)-4-[cyclohexyl(oxo)methyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octan-7-yl]phenyl]benzonitrile (CHEBI:129800) is a biphenyls (CHEBI:22888)
4-[4-[(6R,7R,8R)-4-[cyclohexyl(oxo)methyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octan-7-yl]phenyl]benzonitrile (CHEBI:129800) is a nitrile (CHEBI:18379)
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