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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > azaphilone > (7s,8s,8as)-7,8-dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1h-isochromen-6(7h)-one
... > 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 > azaphilone > (7s,8s,8as)-7,8-dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1h-isochromen-6(7h)-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > azaphilone > (7s,8s,8as)-7,8-dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1h-isochromen-6(7h)-one

Preferred term

(7s,8s,8as)-7,8-dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1h-isochromen-6(7h)-one  

Type

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

Broader concept

charge

  • 0

formula

  • C12H16O4

inchi

  • InChI=1S/C12H16O4/c1-6-4-8-7(2)10(13)12(3,15)11(14)9(8)5-16-6/h4,9,11,14-15H,5H2,1-3H3/t9-,11+,12-/m1/s1

inchikey

  • CGRHRRPYPFDVGZ-ADEWGFFLSA-N

mass

  • 224.256

monoisotopicmass

  • 224.10486

smiles

  • O=C1C(=C2C=C(OC[C@H]2[C@@H]([C@@]1(O)C)O)C)C

subset

  • 2_STAR

synonym EXACT

  • (7S,8S,8aS)-7,8-dihydroxy-3,5,7-trimethyl-8,8a-dihydro-1H-isochromen-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199499

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