3-[4-[(8S,9R,10S)-10-(hydroxymethyl)-6-(3-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:128891)

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CHEBI:128891 - 3-[4-[(8S,9R,10S)-10-(hydroxymethyl)-6-(3-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide

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ChEBI ID	CHEBI:128891
ChEBI Name	3-[4-[(8S,9R,10S)-10-(hydroxymethyl)-6-(3-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide
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Downloads	Molfile

Formula	C30H36N4O2
Net Charge	0
Average Mass	484.644
Monoisotopic Mass	484.28383
SMILES	CN(C)C(=O)c1cccc(-c2ccc([C@H]3[C@@H](CO)N4CCCCN(Cc5cccnc5)C[C@H]34)cc2)c1
InChI	InChI=1S/C30H36N4O2/c1-32(2)30(36)26-9-5-8-25(17-26)23-10-12-24(13-11-23)29-27-20-33(19-22-7-6-14-31-18-22)15-3-4-16-34(27)28(29)21-35/h5-14,17-18,27-29,35H,3-4,15-16,19-21H2,1-2H3/t27-,28-,29-/m1/s1
InChIKey	KXRXTXUVUAPZFH-MPFGFTFXSA-N

ChEBI Ontology

Outgoing Relation(s)
	3-[4-[(8S,9R,10S)-10-(hydroxymethyl)-6-(3-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:128891) is a biphenyls (CHEBI:22888)

Manual Xrefs	Databases
LSM-40443	LINCS