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Concept information

organooxygen compound > polyketide > 3,5-dihydroxy-2-(1'-oxo-3'-hexadecenyl)-2-cyclohexene-1-one
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > enol > 3,5-dihydroxy-2-(1'-oxo-3'-hexadecenyl)-2-cyclohexene-1-one
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > 3,5-dihydroxy-2-(1'-oxo-3'-hexadecenyl)-2-cyclohexene-1-one

Preferred term

3,5-dihydroxy-2-(1'-oxo-3'-hexadecenyl)-2-cyclohexene-1-one  

Type

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

Broader concept

charge

  • 0

formula

  • C22H36O4

inchi

  • InChI=1S/C22H36O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(24)22-20(25)16-18(23)17-21(22)26/h13-14,18,23,25H,2-12,15-17H2,1H3/b14-13+

inchikey

  • YEFDDSMURKQPEL-BUHFOSPRSA-N

mass

  • 364.51880

monoisotopicmass

  • 364.26136

smiles

  • CCCCCCCCCCCC/C=C/CC(=O)C1=C(O)CC(O)CC1=O

subset

  • 3_STAR

synonym EXACT

  • 2-[(3E)-hexadec-3-enoyl]-3,5-dihydroxycyclohex-2-en-1-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65773

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