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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 > olefinic compound > enone > (3r,8e)-3-hydroxy-5,8-megastigmadien-7-one
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > (3r,8e)-3-hydroxy-5,8-megastigmadien-7-one
... > 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 > alpha,beta-unsaturated ketone > enone > (3r,8e)-3-hydroxy-5,8-megastigmadien-7-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > (3r,8e)-3-hydroxy-5,8-megastigmadien-7-one

Preferred term

(3r,8e)-3-hydroxy-5,8-megastigmadien-7-one  

Type

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

Broader concept

charge

  • 0

formula

  • C13H20O2

inchi

  • InChI=1S/C13H20O2/c1-5-6-11(15)12-9(2)7-10(14)8-13(12,3)4/h5-6,10,14H,7-8H2,1-4H3/b6-5+

inchikey

  • UPRXEFYRIACHQZ-AATRIKPKSA-N

mass

  • 208.301

monoisotopicmass

  • 208.14633

smiles

  • OC1CC(C(=C(C1)C)C(=O)/C=C/C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (E)-1-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)but-2-en-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:168043

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