CHEBI:126356 - (6R,7R,8R)-7-[4-(1-cyclohexenyl)phenyl]-8-(hydroxymethyl)-4-[1-oxo-2-(3-pyridinyl)ethyl]-1,4-diazabicyclo[4.2.0]octan-2-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (6R,7R,8R)-7-[4-(1-cyclohexenyl)phenyl]-8-(hydroxymethyl)-4-[1-oxo-2-(3-pyridinyl)ethyl]-1,4-diazabicyclo[4.2.0]octan-2-one
ChEBI ID CHEBI:126356
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H29N3O3
Net Charge 0
Average Mass 431.528
Monoisotopic Mass 431.22089
InChI InChI=1S/C26H29N3O3/c30-17-23-26(21-10-8-20(9-11-21)19-6-2-1-3-7-19)22-15-28(16-25(32)29(22)23)24(31)13-18-5-4-12-27-14-18/h4-6,8-12,14,22-23,26,30H,1-3,7,13,15-17H2/t22-,23-,26+/m0/s1
InChIKey YYSUXJFSBKSHET-JCYRPKCISA-N
SMILES C1CCC(=CC1)C2=CC=C(C=C2)[C@@H]3[C@@H]4CN(CC(=O)N4[C@H]3CO)C(=O)CC5=CN=CC=C5
ChEBI Ontology
Outgoing (6R,7R,8R)-7-[4-(1-cyclohexenyl)phenyl]-8-(hydroxymethyl)-4-[1-oxo-2-(3-pyridinyl)ethyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:126356) is a azetidines (CHEBI:38777)
(6R,7R,8R)-7-[4-(1-cyclohexenyl)phenyl]-8-(hydroxymethyl)-4-[1-oxo-2-(3-pyridinyl)ethyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:126356) is a benzenes (CHEBI:22712)
(6R,7R,8R)-7-[4-(1-cyclohexenyl)phenyl]-8-(hydroxymethyl)-4-[1-oxo-2-(3-pyridinyl)ethyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:126356) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-37921 LINCS
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