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Concept information

Preferred term

heydenoic acid a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O3

inchi

  • InChI=1S/C15H20O3/c1-9(14(17)18)5-4-6-15(3)11-8-12(15)13(16)7-10(11)2/h5,7,11-12H,4,6,8H2,1-3H3,(H,17,18)/b9-5+/t11-,12+,15-/m0/s1

inchikey

  • SCBWJXZVGDGHPJ-KJTIKOJOSA-N

mass

  • 248.322

monoisotopicmass

  • 248.14124

smiles

  • O=C1C=C([C@H]2[C@@]([C@@H]1C2)(CC/C=C(/C(=O)O)/C)C)C

subset

  • 2_STAR

synonym EXACT

  • (E)-5-[(1S,5S,6S)-2,6-dimethyl-4-oxo-6-bicyclo[3.1.1]hept-2-enyl]-2-methylpent-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211886

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