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 > conphysodalic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > conphysodalic acid
... > 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 > conphysodalic acid
... > 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 > conphysodalic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > conphysodalic acid

Preferred term

conphysodalic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C20H18O10

inchi

  • InChI=1S/C20H18O10/c1-7-4-12(23)10(5-21)17-13(7)20(27)30-18-11(6-28-9(3)22)15(24)14(19(25)26)8(2)16(18)29-17/h4,21,23-24H,5-6H2,1-3H3,(H,25,26)

inchikey

  • ADGOFPAXWRMONQ-UHFFFAOYSA-N

mass

  • 418.354

monoisotopicmass

  • 418.09000

smiles

  • O=C1OC2=C(C(=C(C(=O)O)C(=C2COC(=O)C)O)C)OC3=C1C(=CC(=C3CO)O)C

subset

  • 2_STAR

synonym EXACT

  • 4-(acetyloxymethyl)-3,9-dihydroxy-10-(hydroxymethyl)-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202228

Download this concept:

RDF/XML TURTLE JSON-LD