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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-/{[3-hydroxy-10-(3-hydroxybutanoyl)-2,2-dimethyl-8-oxo-6-propyl-2h,3h,4h,8h-pyrano[3,2-g]chromen-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-/{[3-hydroxy-10-(3-hydroxybutanoyl)-2,2-dimethyl-8-oxo-6-propyl-2h,3h,4h,8h-pyrano[3,2-g]chromen-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-/{[3-hydroxy-10-(3-hydroxybutanoyl)-2,2-dimethyl-8-oxo-6-propyl-2h,3h,4h,8h-pyrano[3,2-g]chromen-5-yl]oxy/}oxane-2-carboxylic acid

Preferred term

3,4,5-trihydroxy-6-/{[3-hydroxy-10-(3-hydroxybutanoyl)-2,2-dimethyl-8-oxo-6-propyl-2h,3h,4h,8h-pyrano[3,2-g]chromen-5-yl]oxy/}oxane-2-carboxylic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C27H34O13

inchi

  • InChI=1S/C27H34O13/c1-5-6-11-8-15(31)37-23-16(11)21(38-26-20(34)18(32)19(33)24(39-26)25(35)36)12-9-14(30)27(3,4)40-22(12)17(23)13(29)7-10(2)28/h8,10,14,18-20,24,26,28,30,32-34H,5-7,9H2,1-4H3,(H,35,36)

inchikey

  • WZZSRUOJUFVYND-UHFFFAOYSA-N

mass

  • 566.556

monoisotopicmass

  • 566.19994

smiles

  • O1C(C(O)CC2=C1C(=C3OC(=O)C=C(C3=C2OC4OC(C(O)C(O)C4O)C(O)=O)CCC)C(=O)CC(O)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • 3,4,5-trihydroxy-6-[[3-hydroxy-10-(3-hydroxybutanoyl)-2,2-dimethyl-8-oxo-6-propyl-3,4-dihydropyrano[3,2-g]chromen-5-yl]oxy]oxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190819

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