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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 > carbonyl compound > 3-/{3-[3,5-dihydroxy-4-(sulfooxy)benzoyloxy]-4,5-dihydroxybenzoyloxy/}-2,4,5-trihydroxybenzoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > 3-/{3-[3,5-dihydroxy-4-(sulfooxy)benzoyloxy]-4,5-dihydroxybenzoyloxy/}-2,4,5-trihydroxybenzoic 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 > carbonyl compound > 3-/{3-[3,5-dihydroxy-4-(sulfooxy)benzoyloxy]-4,5-dihydroxybenzoyloxy/}-2,4,5-trihydroxybenzoic 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 > 3-/{3-[3,5-dihydroxy-4-(sulfooxy)benzoyloxy]-4,5-dihydroxybenzoyloxy/}-2,4,5-trihydroxybenzoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > 3-/{3-[3,5-dihydroxy-4-(sulfooxy)benzoyloxy]-4,5-dihydroxybenzoyloxy/}-2,4,5-trihydroxybenzoic acid

Preferred term

3-/{3-[3,5-dihydroxy-4-(sulfooxy)benzoyloxy]-4,5-dihydroxybenzoyloxy/}-2,4,5-trihydroxybenzoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C21H14O17S

inchi

  • InChI=1S/C21H14O17S/c22-9-1-7(21(32)37-18-14(26)8(19(29)30)5-10(23)16(18)28)4-13(15(9)27)36-20(31)6-2-11(24)17(12(25)3-6)38-39(33,34)35/h1-5,22-28H,(H,29,30)(H,33,34,35)

inchikey

  • NEGPRFMLWDOVEL-UHFFFAOYSA-N

mass

  • 570.390

monoisotopicmass

  • 569.99517

smiles

  • S(OC=1C(O)=CC(=CC1O)C(OC2=CC(=CC(O)=C2O)C(OC3=C(O)C(=CC(O)=C3O)C(O)=O)=O)=O)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • 3-[3-(3,5-dihydroxy-4-sulooxybenzoyl)oxy-4,5-dihydroxybenzoyl]oxy-2,4,5-trihydroxybenzoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184316

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