CHEBI:126895 - 4-[4-[(8S,9S,10S)-10-(hydroxymethyl)-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide

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ChEBI Name 4-[4-[(8S,9S,10S)-10-(hydroxymethyl)-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide
ChEBI ID CHEBI:126895
Stars This entity has been manually annotated by a third party.
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Formula C30H36N4O2
Net Charge 0
Average Mass 484.634
Monoisotopic Mass 484.28383
InChI InChI=1S/C30H36N4O2/c1-32(2)30(36)26-11-7-24(8-12-26)23-5-9-25(10-6-23)29-27-20-33(19-22-13-15-31-16-14-22)17-3-4-18-34(27)28(29)21-35/h5-16,27-29,35H,3-4,17-21H2,1-2H3/t27-,28-,29+/m1/s1
InChIKey TZPADAHRXAHUNQ-NLDZOOGBSA-N
SMILES CN(C)C(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)[C@H]3[C@H]4CN(CCCCN4[C@@H]3CO)CC5=CC=NC=C5
ChEBI Ontology
Outgoing 4-[4-[(8S,9S,10S)-10-(hydroxymethyl)-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:126895) is a biphenyls (CHEBI:22888)
Manual Xref Database
LSM-38458 LINCS
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