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Chemistry, part 2

Content language

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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 > isoprenoid > terpenoid > sesquiterpenoid > trigohetone, (rel)-
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > trigohetone, (rel)-

Preferred term

trigohetone, (rel)-  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O4

has_role

inchi

  • InChI=1S/C20H30O4/c1-13(2)11-18(22)19(23)15(4)7-6-10-20(5,24)16-9-8-14(3)12-17(16)21/h7,11-12,16,19,23-24H,6,8-10H2,1-5H3/b15-7+/t16-,19?,20+/m1/s1

inchikey

  • MMCHYQXMIUOBDF-IIZIGAGWSA-N

mass

  • 334.44980

monoisotopicmass

  • 334.21441

smiles

  • [H][C@]1(CCC(C)=CC1=O)[C@@](C)(O)CC/C=C(/C)C(O)C(=O)C=C(C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69175

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