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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 > 6-/{2-[5-(2,4-dihydroxyphenyl)-6-(5-hydroxy-2,2-dimethyl-2h-chromene-6-carbonyl)-3-methylcyclohex-2-en-1-yl]-4-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-3-hydroxyphenoxy/}-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-/{2-[5-(2,4-dihydroxyphenyl)-6-(5-hydroxy-2,2-dimethyl-2h-chromene-6-carbonyl)-3-methylcyclohex-2-en-1-yl]-4-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-3-hydroxyphenoxy/}-3,4,5-trihydroxyoxane-2-carboxylic acid

Preferred term

6-/{2-[5-(2,4-dihydroxyphenyl)-6-(5-hydroxy-2,2-dimethyl-2h-chromene-6-carbonyl)-3-methylcyclohex-2-en-1-yl]-4-[(2e)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-3-hydroxyphenoxy/}-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)19-32(24)51)35(39(54)27-10-12-33-26(37(27)52)14-15-46(2,3)62-33)29(17-20)36-34(60-45-42(57)40(55)41(56)43(61-45)44(58)59)13-9-25(38(36)53)30(49)11-5-21-4-6-22(47)18-31(21)50/h4-15,17-19,28-29,35,40-43,45,47-48,50-53,55-57H,16H2,1-3H3,(H,58,59)/b11-5+

inchikey

  • KRZNIVRDWRPZJK-VZUCSPMQSA-N

mass

  • 852.842

monoisotopicmass

  • 852.26294

smiles

  • O(C1=C(C2C(C(CC(=C2)C)C3=C(O)C=C(O)C=C3)C(=O)C4=C(O)C5=C(OC(C=C5)(C)C)C=C4)C(O)=C(C=C1)C(=O)/C=C/C6=C(O)C=C(O)C=C6)C7OC(C(O)C(O)C7O)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 6-[2-[5-(2,4-dihydroxyphenyl)-6-(5-hydroxy-2,2-dimethylchromene-6-carbonyl)-3-methylcyclohex-2-en-1-yl]-4-[(E)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-3-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185057

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