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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > benzophenones > pestalone f
... > 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 > aromatic ketone > benzophenones > pestalone f
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > benzophenones > pestalone f

Preferred term

pestalone f  

Type

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

Broader concept

charge

  • 0

formula

  • C21H21ClO6

inchi

  • InChI=1S/C21H21ClO6/c1-10(2)5-6-12-14(24)8-15(25)13(9-23)17(12)20(26)18-16(28-4)7-11(3)19(22)21(18)27/h5,7-9,24-25,27H,6H2,1-4H3

inchikey

  • VEWXMVZOXRGIAH-UHFFFAOYSA-N

mass

  • 404.840

monoisotopicmass

  • 404.10267

smiles

  • ClC1=C(O)C(=C(OC)C=C1C)C(=O)C2=C(C(O)=CC(=C2CC=C(C)C)O)C=O

subset

  • 2_STAR

synonym EXACT

  • 2-(3-chloro-2-hydroxy-6-methoxy-4-methylbenzoyl)-4,6-dihydroxy-3-(3-methylbut-2-enyl)benzaldehyde

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210765

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