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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > polyphenol > tannin > 6-(3-carboxy-2,4,6-trihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > polyphenol > tannin > 6-(3-carboxy-2,4,6-trihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > polyphenol > tannin > 6-(3-carboxy-2,4,6-trihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

Preferred term

6-(3-carboxy-2,4,6-trihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C13H14O12

inchi

  • InChI=1S/C13H14O12/c14-2-1-3(15)9(5(16)4(2)11(20)21)24-13-8(19)6(17)7(18)10(25-13)12(22)23/h1,6-8,10,13-19H,(H,20,21)(H,22,23)

inchikey

  • QLKQBJBECIDMRS-UHFFFAOYSA-N

mass

  • 362.243

monoisotopicmass

  • 362.04853

smiles

  • O1C(C(O)C(O)C(O)C1OC=2C(O)=C(C(O)=CC2O)C(O)=O)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 6-(3-carboxy-2,4,6-trihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189905

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