CHEBI:94218 - 2-(4-chlorophenyl)-3-(4-fluorophenyl)-1-(4-morpholinyl)-3-heptanol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(4-chlorophenyl)-3-(4-fluorophenyl)-1-(4-morpholinyl)-3-heptanol
ChEBI ID CHEBI:94218
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C23H29ClFNO2
Net Charge 0
Average Mass 405.934
Monoisotopic Mass 405.18709
InChI InChI=1S/C23H29ClFNO2/c1-2-3-12-23(27,19-6-10-21(25)11-7-19)22(17-26-13-15-28-16-14-26)18-4-8-20(24)9-5-18/h4-11,22,27H,2-3,12-17H2,1H3
InChIKey BTGJJKUUMGGZNO-UHFFFAOYSA-N
SMILES CCCCC(C1=CC=C(C=C1)F)(C(CN2CCOCC2)C3=CC=C(C=C3)Cl)O
ChEBI Ontology
Outgoing 2-(4-chlorophenyl)-3-(4-fluorophenyl)-1-(4-morpholinyl)-3-heptanol (CHEBI:94218) is a stilbenoid (CHEBI:26776)
Manual Xref Database
LSM-4840 LINCS
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