(8S,9R,10R)-9-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-N-(2-fluorophenyl)-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:126265)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:126265 - (8S,9R,10R)-9-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-N-(2-fluorophenyl)-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide

Take structure to advanced search

ChEBI ID	CHEBI:126265
ChEBI Name	(8S,9R,10R)-9-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-N-(2-fluorophenyl)-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide
Stars
Downloads	Molfile

Formula	C27H33FN4O2
Net Charge	0
Average Mass	464.585
Monoisotopic Mass	464.25875
SMILES	CN(C)CC#Cc1ccc([C@@H]2[C@H]3CN(C(=O)Nc4ccccc4F)CCCCN3[C@H]2CO)cc1
InChI	InChI=1S/C27H33FN4O2/c1-30(2)15-7-8-20-11-13-21(14-12-20)26-24-18-31(16-5-6-17-32(24)25(26)19-33)27(34)29-23-10-4-3-9-22(23)28/h3-4,9-14,24-26,33H,5-6,15-19H2,1-2H3,(H,29,34)/t24-,25+,26-/m1/s1
InChIKey	UHSGINZYOHEQBA-UODIDJSMSA-N

ChEBI Ontology

Outgoing Relation(s)
	(8S,9R,10R)-9-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-N-(2-fluorophenyl)-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:126265) is a azetidines (CHEBI:38777)
	(8S,9R,10R)-9-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-N-(2-fluorophenyl)-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:126265) is a benzenes (CHEBI:22712)
	(8S,9R,10R)-9-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-N-(2-fluorophenyl)-10-(hydroxymethyl)-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:126265) is a ring assembly (CHEBI:36820)

Manual Xrefs	Databases
LSM-37831	LINCS