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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate acid derivative > glucosiduronic acid > 6-[(3-carboxy-3-hydroxy-2-/{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy/}propanoyl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > glycosiduronic acid > glucosiduronic acid > 6-[(3-carboxy-3-hydroxy-2-/{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy/}propanoyl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Preferred term

6-[(3-carboxy-3-hydroxy-2-/{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy/}propanoyl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22O15

inchi

  • InChI=1S/C20H22O15/c1-32-9-6-7(2-4-8(9)21)3-5-10(22)33-16(14(26)17(27)28)19(31)35-20-13(25)11(23)12(24)15(34-20)18(29)30/h2-6,11-16,20-21,23-26H,1H3,(H,27,28)(H,29,30)/b5-3+

inchikey

  • BGKRYWQFWGZKSG-HWKANZROSA-N

mass

  • 502.381

monoisotopicmass

  • 502.09587

smiles

  • O1C(C(O)C(O)C(O)C1OC(=O)C(OC(=O)/C=C/C2=CC(OC)=C(O)C=C2)C(O)C(O)=O)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 6-[3-carboxy-3-hydroxy-2-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxypropanoyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183008

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