Myricitrin

CAS Registry Number®

17912-87-7
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CAS Name

Myricitrin

Molecular Formula

C21H20O12

Molecular Mass

464.38

Cite this Page

Myricitrin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=17912-87-7 (retrieved 2024-07-14) (CAS RN: 17912-87-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    197-199 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1

InChIKey

InChIKey=DCYOADKBABEMIQ-OWMUPTOHSA-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]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4

Canonical SMILES

O=C1C(OC2OC(C)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-[(6-deoxy-α-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-
  • Myricitrin
  • 3-[(6-Deoxy-α-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one
  • Myricetin 3-rhamnoside
  • Myricitroside

Deleted or Replaced CAS Registry Numbers

572-28-1, 1329-16-4, 1205539-58-7