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Concept information

Preferred term

6-[1-carboxy-2-(4-methoxy-1-benzofuran-5-yl)-2-oxoethyl]-3,4,5-trihydroxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C18H18O11

inchi

  • InChI=1S/C18H18O11/c1-27-14-6-4-5-28-8(6)3-2-7(14)10(19)9(17(23)24)15-12(21)11(20)13(22)16(29-15)18(25)26/h2-5,9,11-13,15-16,20-22H,1H3,(H,23,24)(H,25,26)

inchikey

  • KNQNRYICSYYPEJ-UHFFFAOYSA-N

mass

  • 410.331

monoisotopicmass

  • 410.08491

smiles

  • O1C(C(O)C(O)C(O)C1C(O)=O)C(C(=O)C2=C(OC)C3=C(OC=C3)C=C2)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 6-[1-carboxy-2-(4-methoxy-1-benzouran-5-yl)-2-oxoethyl]-3,4,5-trihydroxyoxane-2-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190762

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