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Chemistry, part 2

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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > botryosphaeridione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > botryosphaeridione
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > cyclic ketone > alicyclic ketone > cyclohexenones > botryosphaeridione

Preferred term

botryosphaeridione  

Type

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

Broader concept

charge

  • 0

formula

  • C12H12O3

inchi

  • InChI=1S/C12H12O3/c1-7-9(13)4-3-8-5-10(14)11(15)6-12(7,8)2/h3-7,15H,1-2H3/t7-,12-/m0/s1

inchikey

  • VLCRZPUGQUYCEU-MADCSZMMSA-N

mass

  • 204.225

monoisotopicmass

  • 204.07864

smiles

  • O=C1C(O)=C[C@]2([C@H](C(=O)C=CC2=C1)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,8aS)-7-hydroxy-1,8a-dimethyl-1H-naphthalene-2,6-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227121

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