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Concept information

organooxygen compound > oxacycle > benzofurans > (6s,7r,7as)-6,7-dihydroxy-3,6-dimethyl-3,3a,4,5,7,7a-hexahydro-1-benzouran-2-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > (6s,7r,7as)-6,7-dihydroxy-3,6-dimethyl-3,3a,4,5,7,7a-hexahydro-1-benzouran-2-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzofurans > (6s,7r,7as)-6,7-dihydroxy-3,6-dimethyl-3,3a,4,5,7,7a-hexahydro-1-benzouran-2-one

Preferred term

(6s,7r,7as)-6,7-dihydroxy-3,6-dimethyl-3,3a,4,5,7,7a-hexahydro-1-benzouran-2-one  

Type

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

Broader concept

charge

  • 0

formula

  • C10H16O4

inchi

  • InChI=1S/C10H16O4/c1-5-6-3-4-10(2,13)8(11)7(6)14-9(5)12/h5-8,11,13H,3-4H2,1-2H3/t5?,6?,7-,8+,10-/m0/s1

inchikey

  • HEPIMNSIVYQQNN-OTCQGAEESA-N

mass

  • 200.234

monoisotopicmass

  • 200.10486

smiles

  • O=C1O[C@@H]2[C@@H](O)[C@](O)(C)CCC2C1C

subset

  • 2_STAR

synonym EXACT

  • (6S,7R,7aS)-6,7-dihydroxy-3,6-dimethyl-3,3a,4,5,7,7a-hexahydro-1-benzouran-2-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218171

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