skip to main content

Chemistry, part 3

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > 4,7-dichlorounguinol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > 4,7-dichlorounguinol
... > 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 > 4,7-dichlorounguinol
... > 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 > 4,7-dichlorounguinol
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > 4,7-dichlorounguinol

Preferred term

4,7-dichlorounguinol  

Type

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

Broader concept

charge

  • 0

formula

  • C19H16Cl2O5

inchi

  • InChI=1S/C19H16Cl2O5/c1-5-7(2)11-14(21)15(23)9(4)16-18(11)25-17-12(19(24)26-16)8(3)6-10(22)13(17)20/h5-6,22-23H,1-4H3/b7-5+

inchikey

  • GXWHFDWAMBORIU-FNORWQNLSA-N

mass

  • 395.230

monoisotopicmass

  • 394.03748

smiles

  • ClC1=C(O)C(=C2OC(=O)C=3C(OC2=C1/C(=C/C)/C)=C(Cl)C(O)=CC3C)C

subset

  • 2_STAR

synonym EXACT

  • 1-[(E)-but-2-en-2-yl]-2,10-dichloro-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215577

Download this concept:

RDF/XML TURTLE JSON-LD