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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > hydroxyflavan > [3-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl]oxidanesulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > flavans > hydroxyflavan > [3-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl]oxidanesulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > flavans > hydroxyflavan > [3-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl]oxidanesulfonic acid
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > flavans > hydroxyflavan > [3-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl]oxidanesulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 1-benzopyran > flavans > hydroxyflavan > [3-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl]oxidanesulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > benzopyran > 1-benzopyran > flavans > hydroxyflavan > [3-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl]oxidanesulfonic acid

Preferred term

[3-(3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl]oxidanesulfonic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C15H14O7S

inchi

  • InChI=1S/C15H14O7S/c16-11-5-4-9-7-13(17)15(21-14(9)8-11)10-2-1-3-12(6-10)22-23(18,19)20/h1-6,8,13,15-17H,7H2,(H,18,19,20)

inchikey

  • KNALNINWNFZIRA-UHFFFAOYSA-N

mass

  • 338.330

monoisotopicmass

  • 338.04602

smiles

  • S(OC=1C=C(C2OC3=C(CC2O)C=CC(O)=C3)C=CC1)(O)(=O)=O

subset

  • 2_STAR

synonym EXACT

  • [3-(3,7-dihydroxy-3,4-dihydro-2H-chromen-2-yl)phenyl] hydrogen sulate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:193303

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