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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alcohol > primary alcohol > docebenone
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > primary alcohol > docebenone
1,4-benzoquinones > docebenone

Preferred term

docebenone  

Type

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

Broader concept

charge

  • 0

formula

  • C21H26O3

has_role

  • CHEBI:173084
  • CHEBI:64964

inchi

  • InChI=1S/C21H26O3/c1-16-17(2)21(24)19(18(3)20(16)23)14-12-10-8-6-4-5-7-9-11-13-15-22/h22H,5,7-10,12,14-15H2,1-3H3

inchikey

  • WDEABJKSGGRCQA-UHFFFAOYSA-N

mass

  • 326.42930

monoisotopicmass

  • 326.18819

smiles

  • CC1=C(C)C(=O)C(CCCCC#CCCCC#CCO)=C(C)C1=O

subset

  • 3_STAR

synonym EXACT

  • 2-(12-hydroxydodeca-5,10-diyn-1-yl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione
  • Docebenone

synonym RELATED

  • 2-(12-Hydroxy-5,10-dodecadiynyl)-3,5,6-trimethyl-p-benzoquinone
  • 2-(12-hydroxydodeca-5,10-diynyl)-3,5,6-trimethyl-1,4-benzoquinone
  • 2,3,5-trimethyl-6-(12-hydroxy-5,10-dodecadiynyl)-1,4-benzoquinone
  • 6-(12-hydroxydodeca-5,10-diyn-1-yl)-2,3,5-trimethyl-1,4-benzoquinone
  • AA-861
  • AA861
  • docebenona
  • docebenone
  • docebenonum

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:2340

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