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Concept information

Preferred term

(e)-3-methyl-5-(2,6,6-trimethyl-3-oxocyclohex-1-enyl)pent-2-enoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O3

inchi

  • InChI=1S/C15H22O3/c1-10(9-14(17)18)5-6-12-11(2)13(16)7-8-15(12,3)4/h9H,5-8H2,1-4H3,(H,17,18)/b10-9+

inchikey

  • FCZXOGQZJYLSFF-MDZDMXLPSA-N

mass

  • 250.338

monoisotopicmass

  • 250.15689

smiles

  • O=C1C(=C(C(C)(C)CC1)CC/C(=C/C(=O)O)/C)C

subset

  • 2_STAR

synonym EXACT

  • (E)-3-methyl-5-(2,6,6-trimethyl-3-oxocyclohexen-1-yl)pent-2-enoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218476

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