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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > 3,4,5-trihydroxy-6-/{[4-hydroxy-7-methoxy-2,2-dimethyl-6-(3-phenylpropanoyl)-3,4-dihydro-2h-1-benzopyran-5-yl]oxy/}oxane-2-carboxylic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > 3,4,5-trihydroxy-6-/{[4-hydroxy-7-methoxy-2,2-dimethyl-6-(3-phenylpropanoyl)-3,4-dihydro-2h-1-benzopyran-5-yl]oxy/}oxane-2-carboxylic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > 3,4,5-trihydroxy-6-/{[4-hydroxy-7-methoxy-2,2-dimethyl-6-(3-phenylpropanoyl)-3,4-dihydro-2h-1-benzopyran-5-yl]oxy/}oxane-2-carboxylic acid

Preferred term

3,4,5-trihydroxy-6-/{[4-hydroxy-7-methoxy-2,2-dimethyl-6-(3-phenylpropanoyl)-3,4-dihydro-2h-1-benzopyran-5-yl]oxy/}oxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C27H32O11

inchi

  • InChI=1S/C27H32O11/c1-27(2)12-15(29)19-17(38-27)11-16(35-3)18(14(28)10-9-13-7-5-4-6-8-13)23(19)36-26-22(32)20(30)21(31)24(37-26)25(33)34/h4-8,11,15,20-22,24,26,29-32H,9-10,12H2,1-3H3,(H,33,34)

inchikey

  • HNDBQUACGRMKES-UHFFFAOYSA-N

mass

  • 532.542

monoisotopicmass

  • 532.19446

smiles

  • O1C(CC(O)C2=C(OC3OC(C(O)C(O)C3O)C(O)=O)C(=C(OC)C=C12)C(=O)CCC4=CC=CC=C4)(C)C

subset

  • 2_STAR

synonym EXACT

  • 3,4,5-trihydroxy-6-[[4-hydroxy-7-methoxy-2,2-dimethyl-6-(3-phenylpropanoyl)-3,4-dihydrochromen-5-yl]oxy]oxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190821

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