CHEBI:125936 - [(8R,9S,10R)-9-[4-(1-cyclopentenyl)phenyl]-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [(8R,9S,10R)-9-[4-(1-cyclopentenyl)phenyl]-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
ChEBI ID CHEBI:125936
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H33N3O
Net Charge 0
Average Mass 403.561
Monoisotopic Mass 403.26236
InChI InChI=1S/C26H33N3O/c30-19-25-26(23-9-7-22(8-10-23)21-5-1-2-6-21)24-18-28(15-3-4-16-29(24)25)17-20-11-13-27-14-12-20/h5,7-14,24-26,30H,1-4,6,15-19H2/t24-,25-,26-/m0/s1
InChIKey IIEQDBKKVIBHJT-GSDHBNRESA-N
SMILES C1CCN2[C@@H](CN(C1)CC3=CC=NC=C3)[C@@H]([C@@H]2CO)C4=CC=C(C=C4)C5=CCCC5
ChEBI Ontology
Outgoing [(8R,9S,10R)-9-[4-(1-cyclopentenyl)phenyl]-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:125936) is a azetidines (CHEBI:38777)
[(8R,9S,10R)-9-[4-(1-cyclopentenyl)phenyl]-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:125936) is a benzenes (CHEBI:22712)
[(8R,9S,10R)-9-[4-(1-cyclopentenyl)phenyl]-6-(pyridin-4-ylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:125936) is a ring assembly (CHEBI:36820)
Manual Xref Database
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