CHEBI:129604 - (6S,7R,8S)-7-[4-(1-cyclopentenyl)phenyl]-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (6S,7R,8S)-7-[4-(1-cyclopentenyl)phenyl]-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
ChEBI ID CHEBI:129604
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C25H26FN3O3
Net Charge 0
Average Mass 435.492
Monoisotopic Mass 435.19582
InChI InChI=1S/C25H26FN3O3/c26-19-9-11-20(12-10-19)27-25(32)28-13-21-24(22(15-30)29(21)23(31)14-28)18-7-5-17(6-8-18)16-3-1-2-4-16/h3,5-12,21-22,24,30H,1-2,4,13-15H2,(H,27,32)/t21-,22-,24-/m1/s1
InChIKey DSZQZOFAUISKMN-CQOQZXRMSA-N
SMILES C1CC=C(C1)C2=CC=C(C=C2)[C@@H]3[C@H]4CN(CC(=O)N4[C@@H]3CO)C(=O)NC5=CC=C(C=C5)F
ChEBI Ontology
Outgoing (6S,7R,8S)-7-[4-(1-cyclopentenyl)phenyl]-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide (CHEBI:129604) is a azetidines (CHEBI:38777)
(6S,7R,8S)-7-[4-(1-cyclopentenyl)phenyl]-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide (CHEBI:129604) is a benzenes (CHEBI:22712)
(6S,7R,8S)-7-[4-(1-cyclopentenyl)phenyl]-N-(4-fluorophenyl)-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide (CHEBI:129604) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-41155 LINCS
View more database links