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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ether > quercetin 3,3'-dimethyl ether 4'-(2-methylbutyrate)
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > quercetin 3,3'-dimethyl ether 4'-(2-methylbutyrate)

Preferred term

quercetin 3,3'-dimethyl ether 4'-(2-methylbutyrate)  

Type

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

Broader concept

charge

  • 0

formula

  • C22H22O8

inchi

  • InChI=1S/C22H22O8/c1-5-11(2)22(26)30-15-7-6-12(8-16(15)27-3)20-21(28-4)19(25)18-14(24)9-13(23)10-17(18)29-20/h6-11,23-24H,5H2,1-4H3

inchikey

  • GJXSHGNJOOZNFH-UHFFFAOYSA-N

mass

  • 414.410

monoisotopicmass

  • 414.13147

smiles

  • O1C(C2=CC(OC)=C(OC(=O)C(CC)C)C=C2)=C(OC)C(=O)C=3C1=CC(O)=CC3O

subset

  • 2_STAR

synonym EXACT

  • [4-(5,7-dihydroxy-3-methoxy-4-oxochromen-2-yl)-2-methoxyphenyl] 2-methylbutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:179271

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