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Chemistry, part 2

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Concept information

... > organooxygen compound > ether > cyclic ether > epoxide > trichothecene > 8-hexanoylneosolaniol
... > organooxygen compound > oxacycle > cyclic ether > epoxide > trichothecene > 8-hexanoylneosolaniol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > trichothecene > 8-hexanoylneosolaniol
... > 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 > cyclic ether > epoxide > trichothecene > 8-hexanoylneosolaniol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > trichothecene > 8-hexanoylneosolaniol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > trichothecene > 8-hexanoylneosolaniol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > trichothecene > 8-hexanoylneosolaniol
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > trichothecene > 8-hexanoylneosolaniol
... > 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 > organic heteropolycyclic compound > trichothecene > 8-hexanoylneosolaniol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > trichothecene > 8-hexanoylneosolaniol

Preferred term

8-hexanoylneosolaniol  

Type

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

Broader concept

charge

  • 0

formula

  • C25H36O9

inchi

  • InChI=1S/C25H36O9/c1-6-7-8-9-19(28)33-17-11-24(12-30-15(3)26)18(10-14(17)2)34-22-20(29)21(32-16(4)27)23(24,5)25(22)13-31-25/h10,17-18,20-22,29H,6-9,11-13H2,1-5H3/t17-,18+,20+,21+,22+,23+,24+,25?/m0/s1

inchikey

  • NTQOBLPQKXJXCZ-BFAIXHJHSA-N

mass

  • 480.554

monoisotopicmass

  • 480.23593

smiles

  • O1C2([C@]3([C@@]4([C@](O[C@@]2([C@H](O)[C@H]3OC(=O)C)[H])(C=C([C@@H](OC(=O)CCCCC)C4)C)[H])COC(=O)C)C)C1

subset

  • 2_STAR

synonym EXACT

  • [(1S,2R,4S,7R,9R,10R,11S)-11-acetyloxy-2-(acetyloxymethyl)-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] hexanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:175768

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