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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > 3-o-acetyl-5-methylbotcinolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > 3-o-acetyl-5-methylbotcinolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > 3-o-acetyl-5-methylbotcinolide
... > 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 > 3-o-acetyl-5-methylbotcinolide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > 3-o-acetyl-5-methylbotcinolide

Preferred term

3-o-acetyl-5-methylbotcinolide  

Type

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

Broader concept

charge

  • 0

formula

  • C22H36O9

inchi

  • InChI=1S/C22H36O9/c1-7-8-9-16(24)10-11-17(25)31-18-12(2)19(26)22(6,28)20(30-15(5)23)13(3)21(27)29-14(18)4/h10-14,16,18-20,24,26,28H,7-9H2,1-6H3/b11-10+

inchikey

  • GCTUDEYVOWVAEW-ZHACJKMWSA-N

mass

  • 444.521

monoisotopicmass

  • 444.23593

smiles

  • O=C1OC(C(OC(=O)/C=C/C(O)CCCC)C(C)C(C(C(C1C)OC(=O)C)(O)C)O)C

subset

  • 2_STAR

synonym EXACT

  • (7-acetyloxy-5,6-dihydroxy-2,4,6,8-tetramethyl-9-oxooxonan-3-yl) (E)-4-hydroxyoct-2-enoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202117

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