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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > 3,4,5-trihydroxy-6-/{3-[(2e)-3-phenylprop-2-enoyl]phenoxy/}oxane-2-carboxylic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > 3,4,5-trihydroxy-6-/{3-[(2e)-3-phenylprop-2-enoyl]phenoxy/}oxane-2-carboxylic acid

Preferred term

3,4,5-trihydroxy-6-/{3-[(2e)-3-phenylprop-2-enoyl]phenoxy/}oxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C21H20O8

inchi

  • InChI=1S/C21H20O8/c22-15(10-9-12-5-2-1-3-6-12)13-7-4-8-14(11-13)28-21-18(25)16(23)17(24)19(29-21)20(26)27/h1-11,16-19,21,23-25H,(H,26,27)/b10-9+

inchikey

  • TWTQVIQWCKRMHD-MDZDMXLPSA-N

mass

  • 400.383

monoisotopicmass

  • 400.11582

smiles

  • O1C(C(O)C(O)C(O)C1OC=2C=C(C=CC2)C(=O)/C=C/C3=CC=CC=C3)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 3,4,5-trihydroxy-6-[3-[(E)-3-phenylprop-2-enoyl]phenoxy]oxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:188383

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