Quercetin 3-sulfate

CAS Registry Number®

60889-05-6
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CAS Name

Quercetin 3-sulfate

Molecular Formula

C15H10O10S

Molecular Mass

382.30

Cite this Page

Quercetin 3-sulfate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=60889-05-6 (retrieved 2024-03-04) (CAS RN: 60889-05-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H10O10S/c16-7-4-10(19)12-11(5-7)24-14(6-1-2-8(17)9(18)3-6)15(13(12)20)25-26(21,22)23/h1-5,16-19H,(H,21,22,23)

InChIKey

InChIKey=DNAYVNOVGHZZLH-UHFFFAOYSA-N

SMILES

O(S(=O)(=O)O)C1=C(OC=2C(C1=O)=C(O)C=C(O)C2)C3=CC(O)=C(O)C=C3

Canonical SMILES

O=C1C(OS(=O)(=O)O)=C(OC=2C=C(O)C=C(O)C12)C=3C=CC(O)=C(O)C3

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(sulfooxy)-
  • 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-(sulfooxy)-4H-1-benzopyran-4-one
  • Quercetin 3-sulfate
  • Quercetin 3-O-sulfate

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