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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > butanone > asperisocoumarin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > butanone > asperisocoumarin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > butanone > asperisocoumarin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > butanone > asperisocoumarin e
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > butanone > asperisocoumarin e

Preferred term

asperisocoumarin e  

Type

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

Broader concept

charge

  • 0

formula

  • C15H16O5

inchi

  • InChI=1S/C15H16O5/c1-7(2)12(16)14(18)10-5-4-9-6-8(3)20-15(19)11(9)13(10)17/h4-5,7-8,17H,6H2,1-3H3/t8-/m1/s1

inchikey

  • QENIZGPLDNYQLT-MRVPVSSYSA-N

mass

  • 276.288

monoisotopicmass

  • 276.09977

smiles

  • O=C1O[C@@H](CC=2C1=C(O)C(C(=O)C(=O)C(C)C)=CC2)C

subset

  • 2_STAR

synonym EXACT

  • 1-[(3R)-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromen-7-yl]-3-methylbutane-1,2-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206045

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