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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 > isoprenoid > terpenoid > terpene lactone > preaspernidgulene a1
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene lactone > preaspernidgulene a1
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > preaspernidgulene a1
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > preaspernidgulene a1
... > 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 > carboxylic ester > lactone > terpene lactone > preaspernidgulene a1
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > preaspernidgulene a1
organooxygen compound > ester > lactone > terpene lactone > preaspernidgulene a1
organooxygen compound > oxacycle > lactone > terpene lactone > preaspernidgulene a1
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > preaspernidgulene a1
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > preaspernidgulene a1
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > preaspernidgulene a1

Preferred term

preaspernidgulene a1  

Type

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

Broader concept

charge

  • 0

formula

  • C24H30O5

inchi

  • InChI=1S/C24H30O5/c1-15(12-16(2)13-17(3)14-21(25)26)10-8-7-9-11-18(4)23-19(5)22(27)20(6)24(28)29-23/h7-14,19,23,27H,1-6H3,(H,25,26)/t19-,23+/m1/s1

inchikey

  • PZEYJJNSSWZZBI-XXBNENTESA-N

mass

  • 398.499

monoisotopicmass

  • 398.20932

smiles

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

subset

  • 2_STAR

synonym EXACT

  • 13-[(2R,3S)-4-hydroxy-3,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-3,5,7-trimethyltetradeca-2,4,6,8,10,12-hexaenoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227071

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