Myricetin 3-O-glucoside

CAS Registry Number®

19833-12-6

CAS Name

Myricetin 3-O-glucoside

Molecular Formula

C21H20O13

Molecular Mass

480.38

Cite this Page

Myricetin 3-O-glucoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19833-12-6 (retrieved 2024-11-22) (CAS RN: 19833-12-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    275-277 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2/t12-,15-,17+,18-,21+/m1/s1

InChIKey

InChIKey=FOHXFLPXBUAOJM-LIBJPBHASA-N

SMILES

O(C1=C(OC=2C(C1=O)=C(O)C=C(O)C2)C3=CC(O)=C(O)C(O)=C3)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C1C(OC2OC(CO)C(O)C(O)C2O)=C(OC=3C=C(O)C=C(O)C13)C=4C=C(O)C(O)=C(O)C4

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-
  • Isomyricitrin
  • Myricetin 3-glucoside
  • 3-(β-D-Glucopyranosyloxy)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one
  • Myricetin 3-O-glucoside

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Deleted or Replaced CAS Registry Numbers

6822-41-9, 29662-78-0

CAS INSIGHTSTM
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