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CHEBI:127425 - [(8R,9S,10R)-6-(2-methylphenyl)sulfonyl-9-[4-(5-pyrimidinyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

ChEBI IDCHEBI:127425
ChEBI Name[(8R,9S,10R)-6-(2-methylphenyl)sulfonyl-9-[4-(5-pyrimidinyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
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DownloadsMolfile
FormulaC26H30N4O3S
Net Charge0
Average Mass478.618
Monoisotopic Mass478.20386
SMILESCc1ccccc1S(=O)(=O)N1CCCCN2[C@@H](CO)[C@@H](c3ccc(-c4cncnc4)cc3)[C@@H]2C1
InChIInChI=1S/C26H30N4O3S/c1-19-6-2-3-7-25(19)34(32,33)29-12-4-5-13-30-23(16-29)26(24(30)17-31)21-10-8-20(9-11-21)22-14-27-18-28-15-22/h2-3,6-11,14-15,18,23-24,26,31H,4-5,12-13,16-17H2,1H3/t23-,24-,26-/m0/s1
InChIKeyWDCJWRHMHPNYLK-GNKBHMEESA-N
ChEBI Ontology
Outgoing Relation(s)
[(8R,9S,10R)-6-(2-methylphenyl)sulfonyl-9-[4-(5-pyrimidinyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:127425) is a pyrimidines (CHEBI:39447)
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LSM-38983LINCS