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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > benzoate ester > gallate ester > 3-(4-hydroxy-3-methoxyphenyl)-1,2-propanediol 2-o-(galloyl-glucoside)
... > organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > gallate ester > 3-(4-hydroxy-3-methoxyphenyl)-1,2-propanediol 2-o-(galloyl-glucoside)

Preferred term

3-(4-hydroxy-3-methoxyphenyl)-1,2-propanediol 2-o-(galloyl-glucoside)  

Type

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

Broader concept

charge

  • 0

formula

  • C23H28O13

inchi

  • InChI=1S/C23H28O13/c1-33-16-5-10(2-3-13(16)25)4-12(8-24)35-23-21(31)20(30)19(29)17(36-23)9-34-22(32)11-6-14(26)18(28)15(27)7-11/h2-3,5-7,12,17,19-21,23-31H,4,8-9H2,1H3

inchikey

  • DNVSCVOVXAMHOG-UHFFFAOYSA-N

mass

  • 512.464

monoisotopicmass

  • 512.15299

smiles

  • O1C(C(O)C(O)C(O)C1OC(CC2=CC(OC)=C(O)C=C2)CO)COC(=O)C3=CC(O)=C(O)C(O)=C3

subset

  • 2_STAR

synonym EXACT

  • [3,4,5-trihydroxy-6-[1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191558

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