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Chemistry, part 2

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Concept information

... > organooxygen compound > ether > cyclic ether > epoxide > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > organooxygen compound > oxacycle > cyclic ether > epoxide > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > 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 > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > 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 > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > trichothecene > (3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate

Preferred term

(3alpha)-3-hydroxy-12,13-epoxytrichothec-9-ene-4,8,15-triyl triacetate  

Type

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

Broader concept

charge

  • 0

formula

  • C21H28O9

inchi

  • InChI=1S/C21H28O9/c1-10-6-15-20(8-26-11(2)22,7-14(10)28-12(3)23)19(5)17(29-13(4)24)16(25)18(30-15)21(19)9-27-21/h6,14-18,25H,7-9H2,1-5H3/t14?,15-,16-,17?,18-,19-,20-,21+/m1/s1

inchikey

  • BIQPSTSCCIEMEI-FKNPFLQKSA-N

mass

  • 424.446

monoisotopicmass

  • 424.17333

smiles

  • O1[C@@]2([C@]3([C@@]4([C@](O[C@@]2([C@H](O)C3OC(=O)C)[H])(C=C(C(OC(=O)C)C4)C)[H])COC(=O)C)C)C1

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181908

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