CHEBI:129129 - 3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide

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ChEBI Name 3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide
ChEBI ID CHEBI:129129
Stars This entity has been manually annotated by a third party.
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Formula C30H41N3O3
Net Charge 0
Average Mass 491.666
Monoisotopic Mass 491.31479
InChI InChI=1S/C30H41N3O3/c1-31(2)30(35)26-7-5-6-25(18-26)23-8-10-24(11-9-23)29-27-20-32(19-22-12-16-36-17-13-22)14-3-4-15-33(27)28(29)21-34/h5-11,18,22,27-29,34H,3-4,12-17,19-21H2,1-2H3/t27-,28-,29+/m0/s1
InChIKey HTOXPRASVGCNJV-YTCPBCGMSA-N
SMILES CN(C)C(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)[C@@H]3[C@@H]4CN(CCCCN4[C@H]3CO)CC5CCOCC5
ChEBI Ontology
Outgoing 3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:129129) is a biphenyls (CHEBI:22888)
Manual Xref Database
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