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Chemistry, part 3

Content language

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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-hydroxy-4-(sulfooxy)-5-(2,3,4,5-tetrahydroxybenzoyloxy)benzoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > 3-hydroxy-4-(sulfooxy)-5-(2,3,4,5-tetrahydroxybenzoyloxy)benzoic 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-hydroxy-4-(sulfooxy)-5-(2,3,4,5-tetrahydroxybenzoyloxy)benzoic 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-hydroxy-4-(sulfooxy)-5-(2,3,4,5-tetrahydroxybenzoyloxy)benzoic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > 3-hydroxy-4-(sulfooxy)-5-(2,3,4,5-tetrahydroxybenzoyloxy)benzoic acid

Preferred term

3-hydroxy-4-(sulfooxy)-5-(2,3,4,5-tetrahydroxybenzoyloxy)benzoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C14H10O13S

inchi

  • InChI=1S/C14H10O13S/c15-6-3-5(9(17)11(19)10(6)18)14(22)26-8-2-4(13(20)21)1-7(16)12(8)27-28(23,24)25/h1-3,15-19H,(H,20,21)(H,23,24,25)

inchikey

  • CTVDHZDJDNSIRH-UHFFFAOYSA-N

mass

  • 418.280

monoisotopicmass

  • 417.98421

smiles

  • S(OC=1C(OC(=O)C=2C(O)=C(O)C(O)=C(O)C2)=CC(=CC1O)C(O)=O)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • 3-hydroxy-4-sulooxy-5-(2,3,4,5-tetrahydroxybenzoyl)oxybenzoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189020

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