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Chemistry, part 2

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Concept information

organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > c-glycosyl compound > 6-(4,5-dihydroxy-2-/{3,5,7-trihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2h-1-benzopyran-2-yl/}phenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > c-glycosyl compound > 6-(4,5-dihydroxy-2-/{3,5,7-trihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2h-1-benzopyran-2-yl/}phenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > 6-(4,5-dihydroxy-2-/{3,5,7-trihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2h-1-benzopyran-2-yl/}phenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

Preferred term

6-(4,5-dihydroxy-2-/{3,5,7-trihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2h-1-benzopyran-2-yl/}phenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C27H32O18

inchi

  • InChI=1S/C27H32O18/c28-5-14-17(34)18(35)20(37)24(43-14)15-10(31)4-12-6(16(15)33)1-11(32)23(42-12)7-2-8(29)9(30)3-13(7)44-27-22(39)19(36)21(38)25(45-27)26(40)41/h2-4,11,14,17-25,27-39H,1,5H2,(H,40,41)

inchikey

  • OCCKHPFFSJWNMI-UHFFFAOYSA-N

mass

  • 644.535

monoisotopicmass

  • 644.15886

smiles

  • O1C(C(O)C(O)C(O)C1CO)C2=C(O)C=3CC(O)C(OC3C=C2O)C=4C(OC5OC(C(O)C(O)C5O)C(O)=O)=CC(O)=C(O)C4

subset

  • 2_STAR

synonym EXACT

  • 6-[4,5-dihydroxy-2-[3,5,7-trihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-chromen-2-yl]phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:169028

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