CHEBI:126996 - [(8R,9R,10S)-9-[4-(2-methylphenyl)phenyl]-6-(phenylmethyl)sulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

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ChEBI Name [(8R,9R,10S)-9-[4-(2-methylphenyl)phenyl]-6-(phenylmethyl)sulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
ChEBI ID CHEBI:126996
Stars This entity has been manually annotated by a third party.
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Formula C29H34N2O3S
Net Charge 0
Average Mass 490.659
Monoisotopic Mass 490.22901
InChI InChI=1S/C29H34N2O3S/c1-22-9-5-6-12-26(22)24-13-15-25(16-14-24)29-27-19-30(17-7-8-18-31(27)28(29)20-32)35(33,34)21-23-10-3-2-4-11-23/h2-6,9-16,27-29,32H,7-8,17-21H2,1H3/t27-,28+,29+/m0/s1
InChIKey TYDVUMQVQAFQQR-ZGIBFIJWSA-N
SMILES CC1=CC=CC=C1C2=CC=C(C=C2)[C@@H]3[C@@H]4CN(CCCCN4[C@@H]3CO)S(=O)(=O)CC5=CC=CC=C5
ChEBI Ontology
Outgoing [(8R,9R,10S)-9-[4-(2-methylphenyl)phenyl]-6-(phenylmethyl)sulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:126996) is a biphenyls (CHEBI:22888)
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