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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > enone > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > organooxygen compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-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 > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > alpha,beta-unsaturated ketone > enone > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > organooxygen compound > carbonyl compound > ketone > aromatic ketone > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-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 > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-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 > chalcones > 6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

Preferred term

6-(/{6-[6-(2,4-dihydroxyphenyl)-2-/{3-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl/}-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethyl-2h-chromen-5-yl/}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C46H44O16

inchi

  • InChI=1S/C46H44O16/c1-20-16-28(24-8-7-23(48)19-33(24)52)35(29(17-20)36-31(50)12-9-25(37(36)53)30(49)11-5-21-4-6-22(47)18-32(21)51)38(54)27-10-13-34-26(14-15-46(2,3)62-34)42(27)60-45-41(57)39(55)40(56)43(61-45)44(58)59/h4-15,17-19,28-29,35,39-41,43,45,47-48,50-53,55-57H,16H2,1-3H3,(H,58,59)/b11-5+

inchikey

  • VQXSYCGPLCVRNH-VZUCSPMQSA-N

mass

  • 852.842

monoisotopicmass

  • 852.26294

smiles

  • O=C(C1C(CC(=CC1C=2C(O)=C(C=CC2O)C(=O)/C=C/C3=C(O)C=C(O)C=C3)C)C4=C(O)C=C(O)C=C4)C5=C(OC6OC(C(O)C(O)C6O)C(O)=O)C7=C(OC(C=C7)(C)C)C=C5

subset

  • 2_STAR

synonym EXACT

  • 6-[6-[6-(2,4-dihydroxyphenyl)-2-[3-[(E)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl]-4-methylcyclohex-3-ene-1-carbonyl]-2,2-dimethylchromen-5-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190876

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