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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 > orirubenone c
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > orirubenone c
... > 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 > orirubenone c
... > 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 > orirubenone c
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > orirubenone c

Preferred term

orirubenone c  

Type

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

Broader concept

charge

  • 0

formula

  • C16H18O6

inchi

  • InChI=1S/C16H18O6/c1-9-4-3-5-16(2,22-15(9)21)8-14(20)10-6-12(18)13(19)7-11(10)17/h4,6-7,17-19H,3,5,8H2,1-2H3/t16-/m1/s1

inchikey

  • QNBHDATYDIMBOB-MRXNPFEDSA-N

mass

  • 306.314

monoisotopicmass

  • 306.11034

smiles

  • O=C1O[C@](CCC=C1C)(CC(=O)C2=C(O)C=C(O)C(=C2)O)C

subset

  • 2_STAR

synonym EXACT

  • 2,6-dimethyl-2-[2-oxo-2-(2,4,5-trihydroxyphenyl)ethyl]-3,4-dihydrooxepin-7-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210329

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