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Concept information

... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 4-[3-(3,5-ditert-butylphenyl)-3-oxoprop-1-enyl]benzoic acid
... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > chalcones > 4-[3-(3,5-ditert-butylphenyl)-3-oxoprop-1-enyl]benzoic acid

Preferred term

4-[3-(3,5-ditert-butylphenyl)-3-oxoprop-1-enyl]benzoic acid  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C24H28O3

inchi

  • InChI=1S/C24H28O3/c1-23(2,3)19-13-18(14-20(15-19)24(4,5)6)21(25)12-9-16-7-10-17(11-8-16)22(26)27/h7-15H,1-6H3,(H,26,27)

inchikey

  • FOUVTBKPJRMLPE-UHFFFAOYSA-N

mass

  • 364.478

monoisotopicmass

  • 364.20384

smiles

  • CC(C)(C)C1=CC(=CC(=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)O)C(C)(C)C

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:92891

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