CHEBI:93654 - [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(4-propan-2-yl-1-piperazinyl)phenyl]methanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(4-propan-2-yl-1-piperazinyl)phenyl]methanone
ChEBI ID CHEBI:93654
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H28N2O3S
Net Charge 0
Average Mass 472.601
Monoisotopic Mass 472.18206
InChI InChI=1S/C28H28N2O3S/c1-18(2)29-13-15-30(16-14-29)21-7-3-19(4-8-21)27(33)26-24-12-11-23(32)17-25(24)34-28(26)20-5-9-22(31)10-6-20/h3-12,17-18,31-32H,13-16H2,1-2H3
InChIKey LQEOPHGPHCWOAC-UHFFFAOYSA-N
SMILES CC(C)N1CCN(CC1)C2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O
ChEBI Ontology
Outgoing [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(4-propan-2-yl-1-piperazinyl)phenyl]methanone (CHEBI:93654) is a aromatic ketone (CHEBI:76224)
Manual Xref Database
LSM-4127 LINCS
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