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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 46-dimethylcurvulinic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 46-dimethylcurvulinic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 46-dimethylcurvulinic acid
... > 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 > aromatic ketone > 46-dimethylcurvulinic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 46-dimethylcurvulinic acid

Preferred term

46-dimethylcurvulinic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C12H14O5

inchi

  • InChI=1S/C12H14O5/c1-5-8(4-9(14)15)10(7(3)13)12(17)6(2)11(5)16/h16-17H,4H2,1-3H3,(H,14,15)

inchikey

  • OWTQYBKDLMPBEH-UHFFFAOYSA-N

mass

  • 238.239

monoisotopicmass

  • 238.08412

smiles

  • OC=1C(=C(C(=C(O)C1C)C(=O)C)CC(O)=O)C

subset

  • 2_STAR

synonym EXACT

  • 2-(2-acetyl-3,5-dihydroxy-4,6-dimethylphenyl)acetic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181005

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