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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > benzofurans > xanthomonasin a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > xanthomonasin a
... > 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 > benzofurans > xanthomonasin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > xanthomonasin a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > xanthomonasin a
... > 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 > benzofurans > xanthomonasin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzofurans > xanthomonasin a

Preferred term

xanthomonasin a  

Type

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

Broader concept

charge

  • 0

formula

  • C21H24O7

inchi

  • InChI=1S/C21H24O7/c1-4-6-7-8-14(23)15-16-17-12(13(11-22)18(24)27-17)10-21(26,9-5-2)20(16,3)28-19(15)25/h5,9,11,24,26H,4,6-8,10H2,1-3H3/b9-5+/t20-,21-/m0/s1

inchikey

  • IPYDADJCQCMLGC-SJAOVVEKSA-N

mass

  • 388.416

monoisotopicmass

  • 388.15220

smiles

  • O=C1O[C@@]2([C@](O)(/C=C/C)CC3=C(C2=C1C(=O)CCCCC)OC(O)=C3C=O)C

subset

  • 2_STAR

synonym EXACT

  • (5R,5aS)-8-hexanoyl-2,5-dihydroxy-5a-methyl-7-oxo-5-[(E)-prop-1-enyl]-4H-uro[2,3-e][1]benzouran-3-carbaldehyde

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207966

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