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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-/{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-/{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy/}-4h-chromen-3-yl]oxy/}oxan-2-yl)methyl acetate
... > 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-/{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-/{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy/}-4h-chromen-3-yl]oxy/}oxan-2-yl)methyl acetate

Preferred term

(3,4,5-trihydroxy-6-/{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-/{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy/}-4h-chromen-3-yl]oxy/}oxan-2-yl)methyl acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C29H32O17

inchi

  • InChI=1S/C29H32O17/c1-10(31)41-9-17-20(35)23(38)25(40)29(45-17)46-27-21(36)18-14(33)6-13(42-28-24(39)22(37)19(34)16(8-30)44-28)7-15(18)43-26(27)11-2-4-12(32)5-3-11/h2-7,16-17,19-20,22-25,28-30,32-35,37-40H,8-9H2,1H3

inchikey

  • SJHGQJUHKMUKMS-UHFFFAOYSA-N

mass

  • 652.558

monoisotopicmass

  • 652.16395

smiles

  • O1C(C(O)C(O)C(O)C1OC=2C(=O)C=3C(OC2C4=CC=C(O)C=C4)=CC(OC5OC(C(O)C(O)C5O)CO)=CC3O)COC(=O)C

subset

  • 2_STAR

synonym EXACT

  • [3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-3-yl]oxyoxan-2-yl]methyl acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185554

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